Basic information
- Standard SMILES
CCCNC1CCc2nc(N)sc2C1- InChIKey
FASDKYOPVNHBLU-UHFFFAOYSA-N- Molecular formula
- C10H17N3S
- Average molar mass
- 211.33 g/mol
Overview
N6-Propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine is an aralkylamine.
Names & identifiers
- Preferred name
- 4,5,6,7-Tetrahydro-N6-propyl-2,6-benzothiazolediamine
- IUPAC
- 6-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine
- English name
- Pramipexole Impurity 21
- Molecular formula
- C10H17N3S
- Molecular weight
- 211.33
Names & synonyms
104617-86-9RefChem:10693624,5,6,7-Tetrahydro-N6-propyl-2,6-benzothiazolediamineN6-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamineN6-Propyl-4,5,6,7-tetrahydrobenzo[d]thiazole-2,6-diamine(+/-)-Pramipexole6-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamineCHEMBL76399s2460SND 919N~6~-Propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diaminePramipexole Base
Show more names
rac-Pramipexole(±)-Pramipexole, CAS 104617-86-92-Amino-6-propylamino-4,5,6,7-tetrahydrobenzothiazole2,6-Benzothiazolediamine, 4,5,6,7-tetrahydro-N6-propyl-
()-Pramipexole(R)-Pramipexole;R-(+)-Pramipexole;KNS-760704SCHEMBL195775DTXSID9091527DTXSID90274450CHEBI:182913HMS3370D06HMS3393A21
Database identifiers
- CAS
104617-86-9、104678-86-6、556801-24-2- PubChem CID
- 4885
- DTXSID
DTXSID90274450- ChEMBL
CHEMBL76399- ChEBI
CHEBI:182913- EC Number
- 194-374-3、600-591-0
- Nikkaji
- J612.494A
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Experimental & physicochemical properties
DrugsPharmaceuticals
Physicochemical properties
- Melting point
- 137 °C · >137°C (dec.)
- Boiling point
- 377.993 · 377.993±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.171 · 1.171±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- -20 °C · -20°C Freezer, Under inert atmosphere
- solubility
- Chloroform (Slightly, Heated), DMSO (Sparingly), Methanol (Slightly)
- pka
- 9.466 · 9.466±0.20(predicted)
- form
- Solid
- color
- Off-White to Light Beige
Chemistry & industry
Applications
Uses(±)-Pramipexole is a recemic analogue of (S)-Pramipexole (P700755), a dopamine-D2-receptor agonist. Antiparkinsonian.
Suppliers4 total
杭州鼎燕化工有限公司13588754826 13588754826 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
杭州鼎燕化工有限公司0571-87157530-8003 18267553885 · [email protected]
深圳利斯康医药科技有限公司+86-755-89396905 +86-15013857715 · [email protected]
Additional notes
DefinitionChEBI: N6-Propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine is an aralkylamine.
Related reactions
12 records
Linked notes
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