![1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea structure](/static/products/896/896074-69-4.png)
1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea
TL;DR: 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea (CAS 896074-69-4) is a chemical compound with molecular formula C23H29N5O and molecular weight 391.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[2-(azepan-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-3-phenylurea
Also Known As: 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea, 1-[2-[2-(azepan-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-3-phenylurea, 1-(2-(2-(azepan-1-yl)ethyl)-1-methyl-1H-benzo[d]imidazol-5-yl)-3-phenylurea, REGID_for_CID_665861
| Molecular Formula | C23H29N5O |
|---|---|
| Molecular Weight | 391.24 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.2372 |
| Heavy Atoms | 29 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 896074-69-4 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)N=C1CCN4CCCCCC4 |
| InChIKey | HHENTDNXFRRYNC-UHFFFAOYSA-N |
Product Overview
1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea (CAS 896074-69-4), with molecular formula C23H29N5O and molecular weight 391.24 g/mol. IUPAC: 1-[2-[2-(azepan-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-3-phenylurea.
Chemical Property Profile of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea
Property Insights of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea
The XLogP value of 3.5 indicates that 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea. Following Lipinski's Rule of Five, 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea has 2 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 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea?
The CAS number of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea is 896074-69-4.
What is the molecular formula of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea?
The molecular formula of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea is C23H29N5O.
What is the molecular weight of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea?
The molecular weight of 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea is 391.24 g/mol.
Where can I buy 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea?
You can request a quote for 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-{2-[2-(azepan-1-yl)ethyl]-1-methyl-1H-benzimidazol-5-yl}-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.