BAS 05946538
TL;DR: BAS 05946538 (CAS 799252-67-8) is a chemical compound with molecular formula C24H28N2O3 and molecular weight 392.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-hydroxy-3-methoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 05946538, 11-(2-hydroxy-3-methoxyphenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 6-(2-hydroxy-3-methoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C24H28N2O3 |
|---|---|
| Molecular Weight | 392.21 g/mol |
| LogP | 5.23954 |
| Topological Polar Surface Area | 70.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.21 |
| Heavy Atoms | 29 |
| Complexity | 1036.6615 |
Chemical Identifiers
| CAS Number | 799252-67-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=C(C(=CC=C4)OC)O)C(=O)CC(C3)(C)C |
Product Overview
BAS 05946538 (CAS 799252-67-8), with molecular formula C24H28N2O3 and molecular weight 392.21 g/mol. IUPAC: 6-(2-hydroxy-3-methoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 05946538
Property Insights of BAS 05946538
The XLogP value of 5.23954 indicates that BAS 05946538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.59 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05946538. Following Lipinski's Rule of Five, BAS 05946538 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 05946538?
The CAS number of BAS 05946538 is 799252-67-8.
What is the molecular formula of BAS 05946538?
The molecular formula of BAS 05946538 is C24H28N2O3.
What is the molecular weight of BAS 05946538?
The molecular weight of BAS 05946538 is 392.21 g/mol.
Where can I buy BAS 05946538?
You can request a quote for BAS 05946538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05946538?
Yes, KEHONG BIO provides custom synthesis services for BAS 05946538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.