[email protected]
CAS 488816-96-2 2-chloro-4-(2-naphthyl)pyrimidine molecular structure lightbox
CAS RN: 488816-96-2

2-chloro-4-(2-naphthyl)pyrimidine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260415 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS488816-96-2
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

488816-96-2 / 2-chloro-4-naphthalen-2-ylpyrimidine

Standard CAS: 488816-96-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
488816-96-2
Multi CAS
No
Molecular Formula
C14H9CLN2
Molecular Weight
240.690000
Exact Mass
240.045426
InChI
InChI=1S/C14H9ClN2/c15-14-16-8-7-13(17-14)12-6-5-10-3-1-2-4-11(10)9-12/h1-9H
InChIKey
NZIPCHARTLTIOR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
16
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
69.98
TPSA
25.78

LogP / Solubility

WLOGP
3.95
MLOGP
3.48
XLogP3
4.1
Consensus LogP
3.84
Log S (ESOL)
-4.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.39
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.62
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.38

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us