125056-75-9 Usage
Explanation
Different sources of media describe the Explanation of 125056-75-9 differently. You can refer to the following data:
1. The molecular formula represents the number of atoms of each element present in a molecule. In this case, the compound has 14 carbon (C), 14 hydrogen (H), 3 fluorine (F), 3 nitrogen (N), 4 oxygen (O), and 1 sulfur (S) atoms.
2. The pyrimidine ring is the core structure of this compound, consisting of six atoms with alternating single and double bonds. It is a type of heterocyclic aromatic ring, which means it contains more than one type of atom in the ring.
3. The sulfanyl group is a sulfur-oxygen single bond (-S-) that is attached to the compound. It is a functional group that can influence the compound's reactivity and properties.
4. The trifluoromethylphenyl group is a phenyl ring (C6H5) with three fluorine atoms substituted at different positions. In this compound, it is attached to the sulfanyl group at position 6 of the pyrimidine ring.
5. This substituent is attached to position 1 of the pyrimidine ring. It consists of a 2-hydroxyethoxy group (-CH2OCH2CH2OH) and a methyl group (-CH3), which can affect the compound's polarity, solubility, and reactivity.
6. Due to its unique structural features and potential biological activities, this compound may be of interest for further research in the pharmaceutical industry. It could potentially be developed into a drug candidate or used as a starting point for designing new therapeutic agents.
7. While the compound has potential applications in pharmaceutical research, more studies are needed to fully understand its properties, such as its chemical reactivity, stability, and potential interactions with biological targets. This information is crucial for determining its suitability as a drug candidate or for other applications.
Pyrimidine ring
A six-membered heterocyclic aromatic ring
Sulfanyl group
-Sfunctional group
Trifluoromethylphenyl group
C6H4F3
1-[(2-hydroxyethoxy)methyl]-5-methyl substituent
-CH2OCH2CH2OH and -CH3 groups
Pharmaceutical research and development potential
Possible applications in drug discovery
Additional studies needed
Further research required to understand properties and potential uses
Check Digit Verification of cas no
The CAS Registry Mumber 125056-75-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,5,0,5 and 6 respectively; the second part has 2 digits, 7 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 125056-75:
(8*1)+(7*2)+(6*5)+(5*0)+(4*5)+(3*6)+(2*7)+(1*5)=109
109 % 10 = 9
So 125056-75-9 is a valid CAS Registry Number.
125056-75-9Relevant articles and documents
Structure-Activity Relationships of 1--6-(phenylthio)thymine Analogues: Effect of Substitutions at the C-6 Phenyl Ring and at the C-5 Position on Anti-HIV-1 Activity
Tanaka, Hiromichi,Takashima, Hideaki,Ubasawa, Masaru,Sekiya, Kouichi,Nitta, Iasei,et al.
, p. 337 - 345 (2007/10/02)
The effect of substitution on the pyrimidine moiety of 1--6-(phenylthio)thymine (HEPT) and 1--6-(phenylthio)-2-thiothymine (HEPT-S) on anti-HIV-1 activity was investigated by synthesizing a series of 5-methyl-6-(arylthio) and 5-substituted-6-(phenylthio) derivatives.Preparation of the 5-methyl-6-(arylthio) derivatives was carried out based on either LDA lithiation of 1-methyl>thymine (3) and 1-methyl>-2-thiothymine (4) followed by reaction with diaryl disulfides or an addition-elimination reaction of 1-methyl>-6-(phenylsulfinyl)thymine (31) with aromatic thiols.Preparation of the 5-substituted-6-(phenylthio) derivatives was carried out based on either C-5 lithiation of the 1-methyl>-6-(phenylthio)uracil (41) with LTMP or the LDA lithiation of 5-alkyl-1-methyl>-2-thiouracil derivatives 45-47.Substitution at the meta position of the C-6-(phenylthio) ring by the methyl group improved the original anti-HIV-1 activity of HEPT, and introduction of two m-methyl groups to the phenylthio ring further potentiated the activity -1-thymine (28), 0.26 μM; 6--1--2-thiothymine (30), 0.22 μM>.When the 5-methyl group was replaced by an ethyl or an isopropyl group, the anti-HIV-1 activity of HEPT was also improved remarkably -6-(phenylthio)-2-thiouracil (48), 0.11 μM; 5-isopropyl-1--6-(phenylthio)-2-thiouracil (50), 0.059 μM; 5-ethyl-1--6-(phenylthio)-2-thiouracil (54), 0.12 μM; 5-isopropyl-1--6-(phenylthio)-2-thiouracil (56), 0.063 μM>. 6--5-ethyl-1-thymine derivatives 51 and 57 and 6--5-isopropyl-1-thymine derivatives 52 and 58 inhibited the replication of HIV-1 in the nanomolar concentration range.
