1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea
TL;DR: 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea (CAS 77523-95-6) is a chemical compound with molecular formula C15H14N4S and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea
Also Known As: 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea, N-[(1H-1,3-Benzimidazol-2-yl)methyl]-N'-phenylthiourea
| Molecular Formula | C15H14N4S |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.0495 |
| Topological Polar Surface Area | 52.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.0939 |
| Heavy Atoms | 20 |
| Complexity | 687.8314 |
Chemical Identifiers
| CAS Number | 77523-95-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NCC2=NC3=CC=CC=C3N2 |
Product Overview
1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea (CAS 77523-95-6), with molecular formula C15H14N4S and molecular weight 282.09 g/mol. IUPAC: 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea.
Chemical Property Profile of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea
Property Insights of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea
The XLogP value of 3.0495 indicates that 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.74 Ų, 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea has 3 hydrogen bond donor(s) and 2 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-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea?
The CAS number of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea is 77523-95-6.
What is the molecular formula of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea?
The molecular formula of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea is C15H14N4S.
What is the molecular weight of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea?
The molecular weight of 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea is 282.09 g/mol.
Where can I buy 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea?
You can request a quote for 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-benzimidazol-2-ylmethyl)-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.