BIM-0043965.P001
TL;DR: BIM-0043965.P001 (CAS 296247-31-9) is a chemical compound with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-chlorophenyl)-6-(3-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BIM-0043965.P001, A2242/0094427, 3-(4-chlorophenyl)-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9-(4-chlorophenyl)-6-(3-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 14-(4-CHLOROPHENYL)-10-(3-NITROPHENYL)-2,9-DIAZATRICYCLO[9.4.0.0(3),?]PENTADECA-1(11),3,5,7-TETRAEN-12-ONE
| Molecular Formula | C25H20ClN3O3 |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 6.2277 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 445.11932 |
| Heavy Atoms | 32 |
| Complexity | 1253.2968 |
Chemical Identifiers
| CAS Number | 296247-31-9 |
|---|---|
| SMILES | C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=C(C=C5)Cl |
Product Overview
BIM-0043965.P001 (CAS 296247-31-9), with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol. IUPAC: 9-(4-chlorophenyl)-6-(3-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BIM-0043965.P001
Property Insights of BIM-0043965.P001
The XLogP value of 6.2277 indicates that BIM-0043965.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0043965.P001. Following Lipinski's Rule of Five, BIM-0043965.P001 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0043965.P001?
The CAS number of BIM-0043965.P001 is 296247-31-9.
What is the molecular formula of BIM-0043965.P001?
The molecular formula of BIM-0043965.P001 is C25H20ClN3O3.
What is the molecular weight of BIM-0043965.P001?
The molecular weight of BIM-0043965.P001 is 445.12 g/mol.
Where can I buy BIM-0043965.P001?
You can request a quote for BIM-0043965.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0043965.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0043965.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.