Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-
TL;DR: Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- (CAS 113367-95-6) is a chemical compound with molecular formula C16H16N6OS and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methoxyphenyl)thiourea
Also Known As: Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-, 1-((2-Benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thiourea, Thiourea, N-((1H-benzimidazol-2-ylamino)iminomethyl)-N'-(2-methoxyphenyl)-, N-{(E)-[2-(1H-1,3-Benzimidazol-2-yl)hydrazin-1-yl]methylidene}-N'-(2-methoxyphenyl)thiourea, RefChem:387218
| Molecular Formula | C16H16N6OS |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 2.9133 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.11063 |
| Heavy Atoms | 24 |
| Complexity | 842.63995 |
Chemical Identifiers
| CAS Number | 113367-95-6 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=S)/N=C/NNC2=NC3=CC=CC=C3N2 |
Product Overview
Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- (CAS 113367-95-6), with molecular formula C16H16N6OS and molecular weight 340.11 g/mol. IUPAC: (1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methoxyphenyl)thiourea.
Chemical Property Profile of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-
Property Insights of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-
The XLogP value of 2.9133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-. Following Lipinski's Rule of Five, Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- has 4 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 Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-?
The CAS number of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- is 113367-95-6.
What is the molecular formula of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-?
The molecular formula of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- is C16H16N6OS.
What is the molecular weight of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-?
The molecular weight of Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- is 340.11 g/mol.
Where can I buy Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-?
You can request a quote for Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-((2-benzimidazolyl)amidino)-3-(o-methoxyphenyl)-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.