BAS 02056209
TL;DR: BAS 02056209 (CAS 309937-08-4) is a chemical compound with molecular formula C21H21ClN2O2 and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(5-chloro-2-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02056209, AE-848/37241009, 11-(5-chloro-2-hydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 6-(5-chloro-2-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one, 11-(5-Chloro-2-hydroxy-phenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C21H21ClN2O2 |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 5.2675 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 368.12915 |
| Heavy Atoms | 26 |
| Complexity | 933.35834 |
Chemical Identifiers
| CAS Number | 309937-08-4 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=C(C=CC(=C4)Cl)O)C(=O)C1)C |
Product Overview
BAS 02056209 (CAS 309937-08-4), with molecular formula C21H21ClN2O2 and molecular weight 368.13 g/mol. IUPAC: 6-(5-chloro-2-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02056209
Property Insights of BAS 02056209
The XLogP value of 5.2675 indicates that BAS 02056209 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02056209. Following Lipinski's Rule of Five, BAS 02056209 has 3 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 02056209?
The CAS number of BAS 02056209 is 309937-08-4.
What is the molecular formula of BAS 02056209?
The molecular formula of BAS 02056209 is C21H21ClN2O2.
What is the molecular weight of BAS 02056209?
The molecular weight of BAS 02056209 is 368.13 g/mol.
Where can I buy BAS 02056209?
You can request a quote for BAS 02056209 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02056209?
Yes, KEHONG BIO provides custom synthesis services for BAS 02056209 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.