ChemDiv1_003973
TL;DR: ChemDiv1_003973 (CAS 6072-66-8) is a chemical compound with molecular formula C30H26N2O4 and molecular weight 478.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-methoxyphenyl)-6-(6-methyl-4-oxochromen-3-yl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: ChemDiv1_003973, BAS 02170146, BIM-0002262.P001, 3-(4-methoxyphenyl)-11-(6-methyl-4-oxo-4H-chromen-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, A2438/0103322
| Molecular Formula | C30H26N2O4 |
|---|---|
| Molecular Weight | 478.19 g/mol |
| LogP | 6.08952 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 478.18927 |
| Heavy Atoms | 36 |
| Complexity | 1583.127 |
Chemical Identifiers
| CAS Number | 6072-66-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=C(C=C5)OC)NC6=CC=CC=C6N3 |
Product Overview
ChemDiv1_003973 (CAS 6072-66-8), with molecular formula C30H26N2O4 and molecular weight 478.19 g/mol. IUPAC: 9-(4-methoxyphenyl)-6-(6-methyl-4-oxochromen-3-yl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of ChemDiv1_003973
Property Insights of ChemDiv1_003973
The XLogP value of 6.08952 indicates that ChemDiv1_003973 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003973. Following Lipinski's Rule of Five, ChemDiv1_003973 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_003973?
The CAS number of ChemDiv1_003973 is 6072-66-8.
What is the molecular formula of ChemDiv1_003973?
The molecular formula of ChemDiv1_003973 is C30H26N2O4.
What is the molecular weight of ChemDiv1_003973?
The molecular weight of ChemDiv1_003973 is 478.19 g/mol.
Where can I buy ChemDiv1_003973?
You can request a quote for ChemDiv1_003973 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003973?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003973 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.