BAS 05626786
TL;DR: BAS 05626786 (CAS 732258-97-8) is a chemical compound with molecular formula C25H21ClN2O3 and molecular weight 432.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-6-(4-chlorophenyl)-9-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 05626786, 1-[11-(4-chlorophenyl)-3-(furan-2-yl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone, 10-acetyl-11-(4-chlorophenyl)-3-(2-furyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 1-(11-(4-chlorophenyl)-3-(furan-2-yl)-1-hydroxy-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-10(11H)-yl)ethanone, 1-[11-(4-CHLOROPHENYL)-3-(2-FURYL)-1-HYDROXY-2,3,4,11-TETRAHYDRO-10H-DIBENZO[B,E][1,4]DIAZEPIN-10-YL]-1-ETHANONE
| Molecular Formula | C25H21ClN2O3 |
|---|---|
| Molecular Weight | 432.12 g/mol |
| LogP | 5.8535 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 432.12408 |
| Heavy Atoms | 31 |
| Complexity | 1181.7408 |
Chemical Identifiers
| CAS Number | 732258-97-8 |
|---|---|
| SMILES | CC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CO3)NC4=CC=CC=C41)C5=CC=C(C=C5)Cl |
Product Overview
BAS 05626786 (CAS 732258-97-8), with molecular formula C25H21ClN2O3 and molecular weight 432.12 g/mol. IUPAC: 5-acetyl-6-(4-chlorophenyl)-9-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 05626786
Property Insights of BAS 05626786
The XLogP value of 5.8535 indicates that BAS 05626786 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05626786. Following Lipinski's Rule of Five, BAS 05626786 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 05626786?
The CAS number of BAS 05626786 is 732258-97-8.
What is the molecular formula of BAS 05626786?
The molecular formula of BAS 05626786 is C25H21ClN2O3.
What is the molecular weight of BAS 05626786?
The molecular weight of BAS 05626786 is 432.12 g/mol.
Where can I buy BAS 05626786?
You can request a quote for BAS 05626786 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05626786?
Yes, KEHONG BIO provides custom synthesis services for BAS 05626786 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.