BAS 05946532
TL;DR: BAS 05946532 (CAS 577761-91-2) is a chemical compound with molecular formula C25H30N2O3 and molecular weight 406.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,5-dimethoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 05946532, 11-(2,5-dimethoxyphenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 11-(2,5-dimethoxyphenyl)-3,3,7,8-tetramethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol, 6-(2,5-dimethoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C25H30N2O3 |
|---|---|
| Molecular Weight | 406.23 g/mol |
| LogP | 5.54254 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.22565 |
| Heavy Atoms | 30 |
| Complexity | 1052.5995 |
Chemical Identifiers
| CAS Number | 577761-91-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=C(C=CC(=C4)OC)OC)C(=O)CC(C3)(C)C |
Product Overview
BAS 05946532 (CAS 577761-91-2), with molecular formula C25H30N2O3 and molecular weight 406.23 g/mol. IUPAC: 6-(2,5-dimethoxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 05946532
Property Insights of BAS 05946532
The XLogP value of 5.54254 indicates that BAS 05946532 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, BAS 05946532 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 05946532 has 2 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 05946532?
The CAS number of BAS 05946532 is 577761-91-2.
What is the molecular formula of BAS 05946532?
The molecular formula of BAS 05946532 is C25H30N2O3.
What is the molecular weight of BAS 05946532?
The molecular weight of BAS 05946532 is 406.23 g/mol.
Where can I buy BAS 05946532?
You can request a quote for BAS 05946532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05946532?
Yes, KEHONG BIO provides custom synthesis services for BAS 05946532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.