ChemDiv1_007707
TL;DR: ChemDiv1_007707 (CAS 354537-35-2) is a chemical compound with molecular formula C28H25N3O4 and molecular weight 467.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzoyl-9,9-dimethyl-6-(3-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: ChemDiv1_007707, BAS 01832357, 2-benzoyl-9,9-dimethyl-6-(3-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one, 3,3-dimethyl-11-(3-nitrophenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 7-benzoyl-11-{3-nitrophenyl}-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C28H25N3O4 |
|---|---|
| Molecular Weight | 467.18 g/mol |
| LogP | 6.0477 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 467.1845 |
| Heavy Atoms | 35 |
| Complexity | 1392.3212 |
Chemical Identifiers
| CAS Number | 354537-35-2 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C1)C |
Product Overview
ChemDiv1_007707 (CAS 354537-35-2), with molecular formula C28H25N3O4 and molecular weight 467.18 g/mol. IUPAC: 2-benzoyl-9,9-dimethyl-6-(3-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of ChemDiv1_007707
Property Insights of ChemDiv1_007707
The XLogP value of 6.0477 indicates that ChemDiv1_007707 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007707. Following Lipinski's Rule of Five, ChemDiv1_007707 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_007707?
The CAS number of ChemDiv1_007707 is 354537-35-2.
What is the molecular formula of ChemDiv1_007707?
The molecular formula of ChemDiv1_007707 is C28H25N3O4.
What is the molecular weight of ChemDiv1_007707?
The molecular weight of ChemDiv1_007707 is 467.18 g/mol.
Where can I buy ChemDiv1_007707?
You can request a quote for ChemDiv1_007707 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007707?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.