[email protected]
CAS 13382-54-2 2-CHLORO-6-PHENYLPYRIDINE molecular structure lightbox
CAS RN: 13382-54-2

2-CHLORO-6-PHENYLPYRIDINE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260602 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS13382-54-2
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

13382-54-2 / 2-chloro-6-phenylpyridine

Standard CAS: 13382-54-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
13382-54-2
Multi CAS
No
Molecular Formula
C11H8ClN
Molecular Weight
189.640000
Exact Mass
189.034527
SMILES
C1=CC=C(C=C1)C2=NC(=CC=C2)Cl
InChI
InChI=1S/C11H8ClN/c12-11-8-4-7-10(13-11)9-5-2-1-3-6-9/h1-8H
InChIKey
YTAGJMFBUAHVDP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
54.68
TPSA
12.89

LogP / Solubility

WLOGP
3.4
MLOGP
2.99
XLogP3
3.5
Consensus LogP
3.3
Log S (ESOL)
-3.78
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.57
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.84
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.46

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
1.5

Customers Also Viewed

Get In Touch

Contact Us