Basic information
- Name:
2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-N6-propyl-, hydrochloride (1:2), (6S)-
- Superlist Name:
- Pramipexole dihydrochloride
- CAS No.:
104632-25-9
- Molecular Structure:
- Formula:
- C10H17N3S.2(HCl)
- Molecular Weight:
- 284.25
- Synonyms:
- 2,6-Benzothiazolediamine,4,5,6,7-tetrahydro-N6-propyl-, dihydrochloride, (6S)- (9CI);2,6-Benzothiazolediamine, 4,5,6,7-tetrahydro-N6-propyl-, dihydrochloride, (S)-;SND 19;
- Melting Point:
- 288-290 °C
- Boiling Point:
- 378 °C at 760 mmHg
- Flash Point:
- 182.4 °C
- Appearance:
- white crystalline powder
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The CAS registry number of Pramipexole dihydrochloride is 104632-25-9. The IUPAC name is (6S)-6-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine dihydrochloride. In addition, the molecular formula is C10H17N3S.2(HCl) and the molecular weight is 284.25. It is also called 2,6-benzothiazolediamine, 4,5,6,7-tetrahydro-N6-propyl-, dihydrochloride, (S)-. What's more, it is a kind of white crystalline powder and belongs to the classes of Antiparkinsonian; All Inhibitors; Intermediates & Fine Chemicals; Pharmaceuticals; APIs.
Physical properties about this chemical are: (1)ACD/LogP: 1.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.97; (4)ACD/LogD (pH 7.4): -0.53; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.6; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 47.61 Å2; (13)Flash Point: 182.4 °C; (14)Enthalpy of Vaporization: 62.58 kJ/mol; (15)Boiling Point: 378 °C at 760 mmHg; (16)Vapour Pressure: 6.49E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Cl.n1c2c(sc1N)C[C@@H](NCCC)CC2
(2)InChI: InChI=1/C10H17N3S.2ClH/c1-2-5-12-7-3-4-8-9(6-7)14-10(11)13-8;;/h7,12H,2-6H2,1H3,(H2,11,13);2*1H/t7-;;/m0../s1
(3)InChIKey: QMNWXHSYPXQFSK-KLXURFKVBV