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| CAS No.: | 68377-92-4 |
|---|---|
| Name: | AROTINOLOL |
| Molecular Structure: | |
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| Formula: | C15H21 N3 O2 S3 |
| Molecular Weight: | 371.549 |
| Synonyms: | 2-Thiophenecarboxamide,5-[2-[[3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl]thio]-4-thiazolyl]-, (?à)-; (?à)-Arotinolol;2-(3-tert-Butylamino-2-hydroxypropylthio)-4-(5-carbamoyl-2-thienyl)thiazole;Arotinolol; NSC 317940 |
| Density: | 1.35 g/cm3 |
| Melting Point: | 148-149ºC |
| Boiling Point: | 599.8 °C at 760 mmHg |
| Flash Point: | 316.6 °C |
| Appearance: | White solid |
| PSA: | 170.02000 |
| LogP: | 3.90280 |
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Chemistry
Molecular structure of Arotinolol (CAS NO.68377-92-4) is:
Product Name: Arotinolol
CAS Registry Number: 68377-92-4
IUPAC Name: 5-[2-[3-(Tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-carboxamide
Molecular Weight: 371.54114 [g/mol]
Molecular Formula: C15H21N3O2S3
XLogP3-AA: 2.3
H-Bond Donor: 3
H-Bond Acceptor: 4
Index of Refraction: 1.646
Molar Refractivity: 99.5 cm3
Molar Volume: 274 cm3
Surface Tension: 67.8 dyne/cm
Density: 1.35 g/cm3
Flash Point: 316.6 °C
Enthalpy of Vaporization: 93.9 kJ/mol
Boiling Point: 599.8 °C at 760 mmHg
Vapour Pressure: 3.09E-15 mmHg at 25 °C
Other Registry Number: 52560-77-7
Classification Code: Adrenergic alpha-Antagonists ; Adrenergic beta-Antagonists
Canonical SMILES: CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O
InChI: InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)
InChIKey: BHIAIPWSVYSKJS-UHFFFAOYSA-N
Uses
Arotinolol (CAS NO.68377-92-4) can be used in the treatment of high blood pressure.And it has been proposed for use in treatment of essential tremor.
Specification
Arotinolol , its cas register number is 68377-92-4. It also can be called 2-(3-tert-Butylamino-2-hydroxypropylthio)-4-(5-carbamoyl-2-thienyl)thiazole (+-)-5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide ; 2-Thiophenecarboxamide, 5-(2-((3-((1,1-dimethylethyl)amino)-2-hydroxypropyl)thio)-4-thiazolyl)- .