BAS 09588429
TL;DR: BAS 09588429 (CAS 1005060-27-4) is a chemical compound with molecular formula C24H26N2O3 and molecular weight 390.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-(4-ethylphenyl)-9-methyl-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepine-8-carboxylate
Also Known As: BAS 09588429, AE-848/42025169, methyl 11-(4-ethylphenyl)-3-methyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate, A3223/0136790, methyl 6-(4-ethylphenyl)-9-methyl-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepine-8-carboxylate
| Molecular Formula | C24H26N2O3 |
|---|---|
| Molecular Weight | 390.19 g/mol |
| LogP | 4.4799 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.19434 |
| Heavy Atoms | 29 |
| Complexity | 977.87524 |
Chemical Identifiers
| CAS Number | 1005060-27-4 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2C3=C(CC(C(C3=O)C(=O)OC)C)NC4=CC=CC=C4N2 |
Product Overview
BAS 09588429 (CAS 1005060-27-4), with molecular formula C24H26N2O3 and molecular weight 390.19 g/mol. IUPAC: methyl 6-(4-ethylphenyl)-9-methyl-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepine-8-carboxylate.
Chemical Property Profile of BAS 09588429
Property Insights of BAS 09588429
The XLogP value of 4.4799 indicates that BAS 09588429 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09588429. Following Lipinski's Rule of Five, BAS 09588429 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 09588429?
The CAS number of BAS 09588429 is 1005060-27-4.
What is the molecular formula of BAS 09588429?
The molecular formula of BAS 09588429 is C24H26N2O3.
What is the molecular weight of BAS 09588429?
The molecular weight of BAS 09588429 is 390.19 g/mol.
Where can I buy BAS 09588429?
You can request a quote for BAS 09588429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09588429?
Yes, KEHONG BIO provides custom synthesis services for BAS 09588429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.