CAS RN: 1001648-71-0
rac-cis-7-Hydroxy Pramipexole
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250815 | 25mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1001648-71-0
- Purity/Analytical Methods: >99.0%
1001648-71-0 / (6S,7S)-2-amino-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
(6S,7S)-2-amino-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol | (6S,7S)-2-Amino-4,5,6,7-tetrahydro-6-(propylamino)-7-benzothiazolol | W5S8JXQ9VB
Basic Information
CAS
1001648-71-0
Multi CAS
Yes
Molecular Formula
C10H17N3OS
Molecular Weight
227.330000
Exact Mass
227.109233
SMILES
CCCN[C@H]1CCC2=C([C@H]1O)SC(=N2)N
InChI
InChI=1S/C10H17N3OS/c1-2-5-12-6-3-4-7-9(8(6)14)15-10(11)13-7/h6,8,12,14H,2-5H2,1H3,(H2,11,13)/t6-,8-/m0/s1
InChIKey
UWNDKVURLHPSSG-XPUUQOCRSA-N
Synonyms
(6S,7S)-2-amino-6-(propylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
(6S,7S)-2-Amino-4,5,6,7-tetrahydro-6-(propylamino)-7-benzothiazolol
W5S8JXQ9VB
UNII-W5S8JXQ9VB
7-Benzothiazolol, 2-amino-4,5,6,7-tetrahydro-6-(propylamino)-, (6S,7S)
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
5
Fraction Csp3
0.7
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
3
Molar refractivity
61.89
TPSA
71.17
LogP / Solubility
WLOGP
1.07
MLOGP
0.95
XLogP3
0.7
Consensus LogP
0.91
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.2
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.39
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.34
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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