Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-
TL;DR: Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- (CAS 73953-66-9) is a chemical compound with molecular formula C9H8BrN5S and molecular weight 296.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea
Also Known As: 1-(m-Bromophenyl)-3-(3-(1H-1,2,4-triazolyl))-2-thiourea, Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-, 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea, 1-(m-Bromophenyl)-3-(1H-1,2,4-triazol-3-yl)thiourea, 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-3-yl)thiourea
| Molecular Formula | C9H8BrN5S |
|---|---|
| Molecular Weight | 296.97 g/mol |
| LogP | 2.3761 |
| Topological Polar Surface Area | 65.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.96838 |
| Heavy Atoms | 16 |
| Complexity | 484.4044 |
Chemical Identifiers
| CAS Number | 73953-66-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)NC(=S)NC2=NC=NN2 |
Product Overview
Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- (CAS 73953-66-9), with molecular formula C9H8BrN5S and molecular weight 296.97 g/mol. IUPAC: 1-(3-bromophenyl)-3-(1H-1,2,4-triazol-5-yl)thiourea.
Chemical Property Profile of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-
Property Insights of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-
The XLogP value of 2.3761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-. The TPSA of 65.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-. Following Lipinski's Rule of Five, Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- has 3 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 Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-?
The CAS number of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- is 73953-66-9.
What is the molecular formula of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-?
The molecular formula of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- is C9H8BrN5S.
What is the molecular weight of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-?
The molecular weight of Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- is 296.97 g/mol.
Where can I buy Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-?
You can request a quote for Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(m-bromophenyl)-2-thio-3-(1H-1,2,4-triazol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.