![CAS 2682097-84-1 (R)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-aminedihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2682097-84-1.gif)
CAS RN: 2682097-84-1
(R)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-aminedihydrochloride
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251028 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2682097-84-1
- Purity/Analytical Methods: >99.0%
2682097-84-1 / (7R)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-amine;dihydrochloride
Basic Information
CAS
2682097-84-1
Multi CAS
No
Molecular Formula
C8H12Cl2N2
Molecular Weight
207.100000
Exact Mass
206.037754
SMILES
C1CC2=C([C@@H]1N)N=CC=C2.Cl.Cl
InChI
InChI=1S/C8H10N2.2ClH/c9-7-4-3-6-2-1-5-10-8(6)7;;/h1-2,5,7H,3-4,9H2;2*1H/t7-;;/m1../s1
InChIKey
GGQNZTGPGCJQKU-XCUBXKJBSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.38
H-bond acceptors
2
H-bond donors
1
Molar refractivity
53.98
TPSA
38.91
LogP / Solubility
WLOGP
1.87
MLOGP
1.65
XLogP3
1.87
Consensus LogP
1.8
Log S (ESOL)
-2.67
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.61
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.56
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)
-2.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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