BIM-0047752.P001
TL;DR: BIM-0047752.P001 (CAS 674808-15-2) is a chemical compound with molecular formula C25H20ClFN2O and molecular weight 418.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chloro-6-fluorophenyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BIM-0047752.P001, J2.677.148J, 11-(2-chloro-6-fluorophenyl)-3-phenyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol, 11-(2-chloro-6-fluorophenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 10-(2-chloro-6-fluorophenyl)-14-phenyl-2,9-diazatricyclo[9.4.0.0(3),?]pentadeca-1(11),3(8),4,6-tetraen-12-one
| Molecular Formula | C25H20ClFN2O |
|---|---|
| Molecular Weight | 418.12 g/mol |
| LogP | 6.4586 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 418.12482 |
| Heavy Atoms | 30 |
| Complexity | 1138.5701 |
Chemical Identifiers
| CAS Number | 674808-15-2 |
|---|---|
| SMILES | C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=C(C=CC=C4Cl)F)C5=CC=CC=C5 |
Product Overview
BIM-0047752.P001 (CAS 674808-15-2), with molecular formula C25H20ClFN2O and molecular weight 418.12 g/mol. IUPAC: 6-(2-chloro-6-fluorophenyl)-9-phenyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BIM-0047752.P001
Property Insights of BIM-0047752.P001
The XLogP value of 6.4586 indicates that BIM-0047752.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, BIM-0047752.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0047752.P001 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0047752.P001?
The CAS number of BIM-0047752.P001 is 674808-15-2.
What is the molecular formula of BIM-0047752.P001?
The molecular formula of BIM-0047752.P001 is C25H20ClFN2O.
What is the molecular weight of BIM-0047752.P001?
The molecular weight of BIM-0047752.P001 is 418.12 g/mol.
Where can I buy BIM-0047752.P001?
You can request a quote for BIM-0047752.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0047752.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0047752.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.