1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea
TL;DR: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea (CAS 692274-73-0) is a chemical compound with molecular formula C18H20N6O3S3 and molecular weight 464.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea
Also Known As: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea, 4-(3-(3,4-dimethyl-2-thioxo-2,3-dihydrothiazol-5-yl)ureido)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide, N-(4,6-dimethylpyrimidin-2-yl)-4-{[(3,4-dimethyl-2-thioxo-2,3-dihydro-1,3-thiazol-5-yl)carbamoyl]amino}benzenesulfonamide
| Molecular Formula | C18H20N6O3S3 |
|---|---|
| Molecular Weight | 464.08 g/mol |
| LogP | 3.97615 |
| Topological Polar Surface Area | 118.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 464.0759 |
| Heavy Atoms | 30 |
| Complexity | 1243.0592 |
Chemical Identifiers
| CAS Number | 692274-73-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=C(N(C(=S)S3)C)C)C |
Product Overview
1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea (CAS 692274-73-0), with molecular formula C18H20N6O3S3 and molecular weight 464.08 g/mol. IUPAC: 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea.
Chemical Property Profile of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea
Property Insights of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea
The XLogP value of 3.97615 indicates that 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea. Following Lipinski's Rule of Five, 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea has 3 hydrogen bond donor(s) and 7 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 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea?
The CAS number of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea is 692274-73-0.
What is the molecular formula of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea?
The molecular formula of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea is C18H20N6O3S3.
What is the molecular weight of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea?
The molecular weight of 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea is 464.08 g/mol.
Where can I buy 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea?
You can request a quote for 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3,4-dimethyl-2-sulfanylidene-1,3-thiazol-5-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.