BAS 04377435
TL;DR: BAS 04377435 (CAS 296247-39-7) is a chemical compound with molecular formula C26H21F3N2O and molecular weight 434.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-phenyl-6-[4-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 04377435, SDCCGSBI-0658246.P001, 9-phenyl-6-[4-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 3-phenyl-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, A2242/0094419
| Molecular Formula | C26H21F3N2O |
|---|---|
| Molecular Weight | 434.16 g/mol |
| LogP | 6.6849 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 434.16058 |
| Heavy Atoms | 32 |
| Complexity | 1183.6989 |
Chemical Identifiers
| CAS Number | 296247-39-7 |
|---|---|
| SMILES | C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC=C(C=C4)C(F)(F)F)C5=CC=CC=C5 |
Product Overview
BAS 04377435 (CAS 296247-39-7), with molecular formula C26H21F3N2O and molecular weight 434.16 g/mol. IUPAC: 9-phenyl-6-[4-(trifluoromethyl)phenyl]-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 04377435
Property Insights of BAS 04377435
The XLogP value of 6.6849 indicates that BAS 04377435 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, BAS 04377435 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04377435 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 BAS 04377435?
The CAS number of BAS 04377435 is 296247-39-7.
What is the molecular formula of BAS 04377435?
The molecular formula of BAS 04377435 is C26H21F3N2O.
What is the molecular weight of BAS 04377435?
The molecular weight of BAS 04377435 is 434.16 g/mol.
Where can I buy BAS 04377435?
You can request a quote for BAS 04377435 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04377435?
Yes, KEHONG BIO provides custom synthesis services for BAS 04377435 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.