[email protected]
CAS 68303-37-7 N-(5-Chloropyrimidin-2-yl)acetamide molecular structure lightbox
CAS RN: 68303-37-7

N-(5-Chloropyrimidin-2-yl)acetamide

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260313 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS68303-37-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

68303-37-7 / N-(5-chloropyrimidin-2-yl)acetamide

Standard CAS: 68303-37-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
68303-37-7
Multi CAS
No
Molecular Formula
C6H6CLN3O
Molecular Weight
171.580000
Exact Mass
171.019940
InChI
InChI=1S/C6H6ClN3O/c1-4(11)10-6-8-2-5(7)3-9-6/h2-3H,1H3,(H,8,9,10,11)
InChIKey
RJPARKBQHNQWHS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
41.35
TPSA
54.88

LogP / Solubility

WLOGP
1.09
MLOGP
0.95
XLogP3
-0.1
Consensus LogP
0.65
Log S (ESOL)
-1.93
Class (ESOL)
Soluble
Log S (Ali)
-1.75
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.8
Class (SILICOS-IT)
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)
-2.99

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us