N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide
TL;DR: N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide (CAS 838875-23-3) is a chemical compound with molecular formula C15H16ClN3O3S and molecular weight 353.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide
Also Known As: N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide, N-BENZYL-5-CHLORO-2-(PROPANE-1-SULFONYL)PYRIMIDINE-4-CARBOXAMIDE
| Molecular Formula | C15H16ClN3O3S |
|---|---|
| Molecular Weight | 353.06 g/mol |
| LogP | 2.2437 |
| Topological Polar Surface Area | 89.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.0601 |
| Heavy Atoms | 23 |
| Complexity | 794.8693 |
Chemical Identifiers
| CAS Number | 838875-23-3 |
|---|---|
| SMILES | CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NCC2=CC=CC=C2)Cl |
Product Overview
N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide (CAS 838875-23-3), with molecular formula C15H16ClN3O3S and molecular weight 353.06 g/mol. IUPAC: N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide.
Chemical Property Profile of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide
Property Insights of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide
The XLogP value of 2.2437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide. The TPSA of 89.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide. Following Lipinski's Rule of Five, N-benzyl-5-chloro-2-propylsulfonylpyrimidine-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 N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide?
The CAS number of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide is 838875-23-3.
What is the molecular formula of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide?
The molecular formula of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide is C15H16ClN3O3S.
What is the molecular weight of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide?
The molecular weight of N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide is 353.06 g/mol.
Where can I buy N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide?
You can request a quote for N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-5-chloro-2-propylsulfonylpyrimidine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.