2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran
TL;DR: 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran (CAS 866008-56-2) is a chemical compound with molecular formula C19H22N2O4S and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonyl-3-(2,2,4-trimethyl-3H-1-benzofuran-7-yl)urea
Also Known As: 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran, 1-(4-methylbenzenesulfonyl)-3-(2,2,4-trimethyl-2,3-dihydro-1-benzofuran-7-yl)urea, 1-(4-methylphenyl)sulfonyl-3-(2,2,4-trimethyl-3H-1-benzofuran-7-yl)urea, 1-(p-tolylsulfonyl)-3-(2,2,4-trimethyl-3H-benzofuran-7-yl)urea, 1-(4-methylbenzenesulfonyl)-3-(2,2,4-trimethyl-3H-1-benzofuran-7-yl)urea
| Molecular Formula | C19H22N2O4S |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 3.52734 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.13004 |
| Heavy Atoms | 26 |
| Complexity | 963.7788 |
Chemical Identifiers
| CAS Number | 866008-56-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=C3C(=C(C=C2)C)CC(O3)(C)C |
Product Overview
2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran (CAS 866008-56-2), with molecular formula C19H22N2O4S and molecular weight 374.13 g/mol. IUPAC: 1-(4-methylphenyl)sulfonyl-3-(2,2,4-trimethyl-3H-1-benzofuran-7-yl)urea.
Chemical Property Profile of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran
Property Insights of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran
The XLogP value of 3.52734 indicates that 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran. Following Lipinski's Rule of Five, 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran has 2 hydrogen bond donor(s) and 4 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 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran?
The CAS number of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran is 866008-56-2.
What is the molecular formula of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran?
The molecular formula of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran is C19H22N2O4S.
What is the molecular weight of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran?
The molecular weight of 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran is 374.13 g/mol.
Where can I buy 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran?
You can request a quote for 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-trimethyl-7-[({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2,3-dihydro-1-benzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.