3-Methyl-2,7-diphenyl-1,4-diazepan-5-one
TL;DR: 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one (CAS 66110-31-4) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2,7-diphenyl-1,4-diazepan-5-one
Also Known As: 3-methyl-2,7-diphenyl-1,4-diazepan-5-one
| Molecular Formula | C18H20N2O |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 2.967 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.15756 |
| Heavy Atoms | 21 |
| Complexity | 597.13007 |
Chemical Identifiers
| CAS Number | 66110-31-4 |
|---|---|
| SMILES | CC1C(NC(CC(=O)N1)C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
3-Methyl-2,7-diphenyl-1,4-diazepan-5-one (CAS 66110-31-4), with molecular formula C18H20N2O and molecular weight 280.16 g/mol. IUPAC: 3-methyl-2,7-diphenyl-1,4-diazepan-5-one.
Chemical Property Profile of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one
Property Insights of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one
The XLogP value of 2.967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one. With a topological polar surface area (TPSA) of 41.13 Ų, 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one has 2 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 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one?
The CAS number of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one is 66110-31-4.
What is the molecular formula of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one?
The molecular formula of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one is C18H20N2O.
What is the molecular weight of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one?
The molecular weight of 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one is 280.16 g/mol.
Where can I buy 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one?
You can request a quote for 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2,7-diphenyl-1,4-diazepan-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.