1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-
TL;DR: 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- (CAS 54112-23-1) is a chemical compound with molecular formula C27H32N4O4 and molecular weight 476.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-N-[4-[[4-[(2-oxoazepane-1-carbonyl)amino]phenyl]methyl]phenyl]azepane-1-carboxamide
Also Known As: EC 258-981-8, 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-, N,N'-(Methylenedi-p-phenylene)bis[hexahydro-2-oxo-1H-azepine-1-carboxamide], 2-oxo-N-[4-[[4-[(2-oxoazepane-1-carbonyl)amino]phenyl]methyl]phenyl]azepane-1-carboxamide, N,N'- bis[hexahydro-2-oxo-1H-azepine-1-carboxamide]
| Molecular Formula | C27H32N4O4 |
|---|---|
| Molecular Weight | 476.24 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 98.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.24237 |
| Heavy Atoms | 35 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 54112-23-1 |
|---|---|
| SMILES | C1CCC(=O)N(CC1)C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)N4CCCCCC4=O |
| InChIKey | CFDIRYSIEKJPRZ-UHFFFAOYSA-N |
Product Overview
1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- (CAS 54112-23-1), with molecular formula C27H32N4O4 and molecular weight 476.24 g/mol. IUPAC: 2-oxo-N-[4-[[4-[(2-oxoazepane-1-carbonyl)amino]phenyl]methyl]phenyl]azepane-1-carboxamide.
Chemical Property Profile of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-
Property Insights of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-
The XLogP value of 3.3 indicates that 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-. Following Lipinski's Rule of Five, 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- has 2 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 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-?
The CAS number of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- is 54112-23-1.
What is the molecular formula of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-?
The molecular formula of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- is C27H32N4O4.
What is the molecular weight of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-?
The molecular weight of 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- is 476.24 g/mol.
Where can I buy 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-?
You can request a quote for 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepine-1-carboxamide, N,N'-(methylenedi-4,1-phenylene)bis[hexahydro-2-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.