[email protected]
CAS 64119-42-2 6-chloro-5-cyano-2-methyl-3-Pyridinecarboxylic acid ethyl ester molecular structure lightbox
CAS RN: 64119-42-2

6-chloro-5-cyano-2-methyl-3-Pyridinecarboxylic acid ethyl ester

  • Product code: SSC-173888
GET A QUOTE
Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 64119-42-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g -- 5 In Stock Beijing Inquiry
0.25g >95% 5 In Stock Shenzhen Inquiry
1g -- 5 In Stock Hong Kong Inquiry
1g >95% 5 In Stock Beijing Inquiry
5g -- 2 In Stock Hong Kong Inquiry
5g >95% 2 In Stock Hong Kong Inquiry

64119-42-2 / ethyl 6-chloro-5-cyano-2-methylpyridine-3-carboxylate

Standard CAS: 64119-42-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
64119-42-2
Multi CAS
No
Molecular Formula
C10H9CLN2O2
Molecular Weight
224.640000
Exact Mass
224.035255
InChI
InChI=1S/C10H9ClN2O2/c1-3-15-10(14)8-4-7(5-12)9(11)13-6(8)2/h4H,3H2,1-2H3
InChIKey
QXZBVLFURRXJLB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
54.66
TPSA
62.98

LogP / Solubility

WLOGP
2.09
MLOGP
1.84
XLogP3
2.2
Consensus LogP
2.04
Log S (ESOL)
-2.71
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.91
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.1
Class (SILICOS-IT)
Poorly 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)
-2.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us