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Cas Database |
| Name |
Panipenem |
EINECS | N/A |
| CAS No. | 87726-17-8 | Density | 1.62 g/cm3 |
| PSA | 130.23000 | LogP | 0.67430 |
| Solubility | N/A | Melting Point |
198-200° (dec) |
| Formula | C15H21N3O4S | Boiling Point | 555.5 °C at 760 mmHg |
| Molecular Weight | 339.415 | Flash Point | 289.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylicacid, 6-(1-hydroxyethyl)-3-[[1-(1-iminoethyl)-3-pyrrolidinyl]thio]-7-oxo-,[5R-[3(S*),5a,6a(R*)]]-;Panipenemum; |
Article Data | 2 |
Panipenem Chemical Properties
Molecular Structure of Panipenemum (CAS NO.87726-17-8):
.png)
IUPAC Name: (5R,6S)-3-[(3S)-1-ethanimidoylpyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Empirical Formula: C15H21N3O4S
Molecular Weight: 339.4099
H bond acceptors: 7
H bond donors: 3
Freely Rotating Bonds: 5
Polar Surface Area: 130.23 Å2
Index of Refraction: 1.745
Molar Refractivity: 84.7 cm3
Molar Volume: 208.8 cm3
Surface Tension: 68.9 dyne/cm
Density: 1.62 g/cm3
Flash Point: 289.7 °C
Enthalpy of Vaporization: 96.17 kJ/mol
Boiling Point: 555.5 °C at 760 mmHg
Vapour Pressure: 1.18E-14 mmHg at 25°C
CAS: 87726-17-8
InChI
InChI=1/C15H21N3O4S/c1-7(19)12-10-5-11(13(15(21)22)18(10)14(12)20)23-9-3-4-17(6-9)8(2)16/h7,9-10,12,16,19H,3-6H2,1-2H3,(H,21,22)/t7-,9+,10-,12-/m1/s1
Smiles
C1([C@H]([C@@H](C)O)[C@@H]2N1C(=C(C2)S[C@@H]1CN(CC1)C(=N)C)C(O)=O)=O
Classification Code: Drug / Therapeutic Agent
Product Categories: Antibacterial
Panipenem Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 1632ug/kg (1.632mg/kg) | Journal of Antibiotics. Vol. 48, Pg. 408, 1995. | |
| rat | LD50 | intravenous | 1300mg/kg (1300mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA LUNGS, THORAX, OR RESPIRATION: CYANOSIS | Chemotherapy Vol. 39(Suppl, |
Panipenem Specification
Panipenemum , with CAS number of 87726-17-8, can be called Panipenem ; (5r,6s)-2-[1-acetamidoylpyrrolidin-3(s)-ylthio]-6-[1(r)-hydroxyethyl]-2-carbapenem-3-carboxylic acid ; (5r-(3(s*),5-alpha,6-alpha(r*)))-inoethyl)-3-pyrrolidinyl)thio)-7-oxo ; 1-azabicyclo(3.2.0)hept-2-ene-2-carboxylicacid,6-(1-hydroxyethyl)-3-((1-(1-im ; 6-(1-hydroxyethyl)-2-(1-acetimidoylpyrrolidin-3-ylthio)-1-carbaren-2-em-3-ca ; carbapenemrs-533 ; faropenem, 90.0% .
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