5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide
TL;DR: 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide (CAS 838903-99-4) is a chemical compound with molecular formula C14H14ClN3O3S and molecular weight 339.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide
Also Known As: 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide, 5-chloro-2-esyl-N-(p-tolyl)pyrimidine-4-carboxamide, 5-chloro-2-(ethylsulfonyl)-N-(4-methylphenyl)-4-pyrimidinecarboxamide, 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)-4-pyrimidinecarboxamide, 5-chloranyl-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide
| Molecular Formula | C14H14ClN3O3S |
|---|---|
| Molecular Weight | 339.04 g/mol |
| LogP | 2.48432 |
| Topological Polar Surface Area | 89.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.04443 |
| Heavy Atoms | 22 |
| Complexity | 804.5828 |
Chemical Identifiers
| CAS Number | 838903-99-4 |
|---|---|
| SMILES | CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)C)Cl |
Product Overview
5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide (CAS 838903-99-4), with molecular formula C14H14ClN3O3S and molecular weight 339.04 g/mol. IUPAC: 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide.
Chemical Property Profile of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide
Property Insights of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide
The XLogP value of 2.48432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide. The TPSA of 89.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide. Following Lipinski's Rule of Five, 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide?
The CAS number of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide is 838903-99-4.
What is the molecular formula of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide?
The molecular formula of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide is C14H14ClN3O3S.
What is the molecular weight of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide?
The molecular weight of 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide is 339.04 g/mol.
Where can I buy 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide?
You can request a quote for 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-2-ethylsulfonyl-N-(4-methylphenyl)pyrimidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.