methyl}-3-(4-methylphenyl)thiourea structure](/static/products/2019/201990-00-3.webp)
1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea
TL;DR: 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea (CAS 201990-00-3) is a chemical compound with molecular formula C21H19N3O2S2 and molecular weight 409.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-(4-methylphenyl)thiourea
Also Known As: 1-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-(4-methylphenyl)thiourea, 1-{[(benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea
| Molecular Formula | C21H19N3O2S2 |
|---|---|
| Molecular Weight | 409.09 g/mol |
| LogP | 4.11712 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.09186 |
| Heavy Atoms | 28 |
| Complexity | 1079.5142 |
Chemical Identifiers
| CAS Number | 201990-00-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea (CAS 201990-00-3), with molecular formula C21H19N3O2S2 and molecular weight 409.09 g/mol. IUPAC: 1-[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea
Property Insights of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea
The XLogP value of 4.11712 indicates that 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea. Following Lipinski's Rule of Five, 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea has 2 hydrogen bond donor(s) and 3 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-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea?
The CAS number of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea is 201990-00-3.
What is the molecular formula of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea?
The molecular formula of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea is C21H19N3O2S2.
What is the molecular weight of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea?
The molecular weight of 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea is 409.09 g/mol.
Where can I buy 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea?
You can request a quote for 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-{[(Benzenesulfonyl)imino](phenyl)methyl}-3-(4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.