CAS RN: 690265-87-3
(R)-1-(5-bromo-pyridin-2-yl)-pyrrolidin-3-ol
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260429 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS690265-87-3
- Purity/Analytical Methods: >99.0%
690265-87-3 / 1-(5-bromo-2-pyridinyl)pyrrolidin-3-ol
Basic Information
CAS
690265-87-3
Multi CAS
Yes
Molecular Formula
BC9H11ORn2
Molecular Weight
243.100000
Exact Mass
242.005480
InChI
InChI=1S/C9H11BrN2O/c10-7-1-2-9(11-5-7)12-4-3-8(13)6-12/h1-2,5,8,13H,3-4,6H2
InChIKey
SXRFQXQWZRXLBR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.44
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
54.77
TPSA
36.36
LogP / Solubility
WLOGP
1.42
MLOGP
1.25
XLogP3
1.5
Consensus LogP
1.39
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.53
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)
-3.2
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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