N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide
TL;DR: N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide (CAS 573694-57-2) is a chemical compound with molecular formula C14H17N3O and molecular weight 243.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide
Also Known As: TimTec1_007525, N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide, IDI1_033179, BAS 06911083, N-(perhydrobenzimidazol-2-ylidene)benzamide
| Molecular Formula | C14H17N3O |
|---|---|
| Molecular Weight | 243.14 g/mol |
| LogP | 1.6868 |
| Topological Polar Surface Area | 53.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.13716 |
| Heavy Atoms | 18 |
| Complexity | 469.18726 |
Chemical Identifiers
| CAS Number | 573694-57-2 |
|---|---|
| SMILES | C1CCC2C(C1)NC(=N2)NC(=O)C3=CC=CC=C3 |
Product Overview
N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide (CAS 573694-57-2), with molecular formula C14H17N3O and molecular weight 243.14 g/mol. IUPAC: N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide.
Chemical Property Profile of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide
Property Insights of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide
The XLogP value of 1.6868 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide. With a topological polar surface area (TPSA) of 53.49 Ų, N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide 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 N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide?
The CAS number of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide is 573694-57-2.
What is the molecular formula of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide?
The molecular formula of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide is C14H17N3O.
What is the molecular weight of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide?
The molecular weight of N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide is 243.14 g/mol.
Where can I buy N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide?
You can request a quote for N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.