3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
TL;DR: 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione (CAS 58445-88-8) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-1-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione
Also Known As: J1.281.356B, 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione, 3-benzyl-1-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione, 1-Methyl-3-benzyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dione, 3-benzyl-1-methyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dione
| Molecular Formula | C17H16N2O2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 2.0041 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.1212 |
| Heavy Atoms | 21 |
| Complexity | 682.1993 |
Chemical Identifiers
| CAS Number | 58445-88-8 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=O)NC(C1=O)CC3=CC=CC=C3 |
Product Overview
3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione (CAS 58445-88-8), with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol. IUPAC: 3-benzyl-1-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione.
Chemical Property Profile of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Property Insights of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
The XLogP value of 2.0041 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione. With a topological polar surface area (TPSA) of 49.41 Ų, 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione has 1 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-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione?
The CAS number of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione is 58445-88-8.
What is the molecular formula of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione?
The molecular formula of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione is C17H16N2O2.
What is the molecular weight of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione?
The molecular weight of 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione is 280.12 g/mol.
Where can I buy 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione?
You can request a quote for 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-1-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.