![1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea structure](/static/products/774/774563-17-6.png)
1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea
TL;DR: 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea (CAS 774563-17-6) is a chemical compound with molecular formula C22H22Cl2N6O3 and molecular weight 488.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea
Also Known As: 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea, 3-(3a,4,5,6,7,7a-hexahydro-1H-1,3-benzodiazol-2-yl)-1-(4-chlorophenyl)-1-({[(4-chlorophenyl)carbamoyl]amino}carbonyl)urea, N,N-bis(4-chlorophenyl)-N'-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)tricarbonodiimidic diamide
| Molecular Formula | C22H22Cl2N6O3 |
|---|---|
| Molecular Weight | 488.11 g/mol |
| LogP | 4.7215 |
| Topological Polar Surface Area | 114.93 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 488.11304 |
| Heavy Atoms | 33 |
| Complexity | 1074.5437 |
Chemical Identifiers
| CAS Number | 774563-17-6 |
|---|---|
| SMILES | C1CCC2C(C1)NC(=N2)NC(=O)N(C3=CC=C(C=C3)Cl)C(=O)NC(=O)NC4=CC=C(C=C4)Cl |
Product Overview
1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea (CAS 774563-17-6), with molecular formula C22H22Cl2N6O3 and molecular weight 488.11 g/mol. IUPAC: 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea.
Chemical Property Profile of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea
Property Insights of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea
The XLogP value of 4.7215 indicates that 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea. Following Lipinski's Rule of Five, 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea has 4 hydrogen bond donor(s) and 5 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-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea?
The CAS number of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea is 774563-17-6.
What is the molecular formula of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea?
The molecular formula of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea is C22H22Cl2N6O3.
What is the molecular weight of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea?
The molecular weight of 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea is 488.11 g/mol.
Where can I buy 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea?
You can request a quote for 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylcarbamoyl)-1-(4-chlorophenyl)-3-[(4-chlorophenyl)carbamoyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.