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CAS 524674-59-7 2-Chloro-6-pyrrolidin-2-yl-pyridine molecular structure lightbox
CAS RN: 524674-59-7

2-Chloro-6-pyrrolidin-2-yl-pyridine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250501 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS524674-59-7
  • Purity/Analytical Methods: >99.0%
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524674-59-7 / 2-chloro-6-pyrrolidin-2-ylpyridine

Standard CAS: 524674-59-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
524674-59-7
Multi CAS
No
Molecular Formula
C9H11CLN2
Molecular Weight
182.650000
Exact Mass
182.061076
InChI
InChI=1S/C9H11ClN2/c10-9-5-1-3-8(12-9)7-4-2-6-11-7/h1,3,5,7,11H,2,4,6H2
InChIKey
GBUAOTWEEYSOGG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.44
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
49.22
TPSA
24.92

LogP / Solubility

WLOGP
2.16
MLOGP
1.9
XLogP3
1.7
Consensus LogP
1.92
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
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)
-2.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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