![1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea structure](/static/products/315/315201-97-9.png)
1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea
TL;DR: 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea (CAS 315201-97-9) is a chemical compound with molecular formula C19H19N5OS4 and molecular weight 461.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea
Also Known As: 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea, 2-({[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)-N-(4-methylphenyl)hydrazinecarbothioamide, 2-(2-((5-(benzylthio)-1,3,4-thiadiazol-2-yl)thio)acetyl)-N-(p-tolyl)hydrazinecarbothioamide, 3-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-1-(4-methylphenyl)thiourea
| Molecular Formula | C19H19N5OS4 |
|---|---|
| Molecular Weight | 461.05 g/mol |
| LogP | 4.24872 |
| Topological Polar Surface Area | 78.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.04724 |
| Heavy Atoms | 29 |
| Complexity | 946.74805 |
Chemical Identifiers
| CAS Number | 315201-97-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NN=C(S2)SCC3=CC=CC=C3 |
Product Overview
1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea (CAS 315201-97-9), with molecular formula C19H19N5OS4 and molecular weight 461.05 g/mol. IUPAC: 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea
Property Insights of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea
The XLogP value of 4.24872 indicates that 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea. Following Lipinski's Rule of Five, 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea 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-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea?
The CAS number of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea is 315201-97-9.
What is the molecular formula of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea?
The molecular formula of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea is C19H19N5OS4.
What is the molecular weight of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea?
The molecular weight of 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea is 461.05 g/mol.
Where can I buy 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea?
You can request a quote for 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-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-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-3-(4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.