ChemDiv3_015606
TL;DR: ChemDiv3_015606 (CAS 879930-18-4) is a chemical compound with molecular formula C17H16ClN5O3S3 and molecular weight 469.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-propylsulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide
Also Known As: ChemDiv3_015606, 5-chloro-2-(propylsulfanyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide, 5-chloro-2-propylsulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide, 5-chloro-2-(propylsulfanyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}pyrimidine-4-carboxamide
| Molecular Formula | C17H16ClN5O3S3 |
|---|---|
| Molecular Weight | 469.01 g/mol |
| LogP | 4.1417 |
| Topological Polar Surface Area | 113.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.01038 |
| Heavy Atoms | 29 |
| Complexity | 1090.0111 |
Chemical Identifiers
| CAS Number | 879930-18-4 |
|---|---|
| SMILES | CCCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)Cl |
Product Overview
ChemDiv3_015606 (CAS 879930-18-4), with molecular formula C17H16ClN5O3S3 and molecular weight 469.01 g/mol. IUPAC: 5-chloro-2-propylsulfanyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrimidine-4-carboxamide.
Chemical Property Profile of ChemDiv3_015606
Property Insights of ChemDiv3_015606
The XLogP value of 4.1417 indicates that ChemDiv3_015606 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.94 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_015606. Following Lipinski's Rule of Five, ChemDiv3_015606 has 2 hydrogen bond donor(s) and 8 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 ChemDiv3_015606?
The CAS number of ChemDiv3_015606 is 879930-18-4.
What is the molecular formula of ChemDiv3_015606?
The molecular formula of ChemDiv3_015606 is C17H16ClN5O3S3.
What is the molecular weight of ChemDiv3_015606?
The molecular weight of ChemDiv3_015606 is 469.01 g/mol.
Where can I buy ChemDiv3_015606?
You can request a quote for ChemDiv3_015606 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_015606?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_015606 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.