1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea
TL;DR: 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea (CAS 374615-89-1) is a chemical compound with molecular formula C21H20N2O3S2 and molecular weight 412.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea
Also Known As: 1-(4-methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea, 4-methyl-N-((3-phenoxybenzyl)carbamothioyl)benzenesulfonamide, 4-methyl-N-[(3-phenoxybenzyl)carbamothioyl]benzenesulfonamide, 3-(4-METHYLBENZENESULFONYL)-1-[(3-PHENOXYPHENYL)METHYL]THIOUREA, [(4-methylphenyl)sulfonyl]({[(3-phenoxyphenyl)methyl]amino}thioxomethyl)amine
| Molecular Formula | C21H20N2O3S2 |
|---|---|
| Molecular Weight | 412.09 g/mol |
| LogP | 4.14032 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.09152 |
| Heavy Atoms | 28 |
| Complexity | 1050.5236 |
Chemical Identifiers
| CAS Number | 374615-89-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=S)NCC2=CC(=CC=C2)OC3=CC=CC=C3 |
Product Overview
1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea (CAS 374615-89-1), with molecular formula C21H20N2O3S2 and molecular weight 412.09 g/mol. IUPAC: 1-(4-methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea.
Chemical Property Profile of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea
Property Insights of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea
The XLogP value of 4.14032 indicates that 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea. Following Lipinski's Rule of Five, 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea 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 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea?
The CAS number of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea is 374615-89-1.
What is the molecular formula of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea?
The molecular formula of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea is C21H20N2O3S2.
What is the molecular weight of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea?
The molecular weight of 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea is 412.09 g/mol.
Where can I buy 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea?
You can request a quote for 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylphenyl)sulfonyl-3-[(3-phenoxyphenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.