BAS 05946545
TL;DR: BAS 05946545 (CAS 577997-11-6) is a chemical compound with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-hydroxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 05946545, 11-(4-HYDROXYPHENYL)-3,3,7,8-TETRAMETHYL-2,3,4,5,10,11-HEXAHYDRO-1H-DIBENZO[B,E][1,4]DIAZEPIN-1-ONE, 11-(4-hydroxyphenyl)-3,3,7,8-tetramethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol, 6-(4-hydroxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C23H26N2O2 |
|---|---|
| Molecular Weight | 362.20 g/mol |
| LogP | 5.23094 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.19943 |
| Heavy Atoms | 27 |
| Complexity | 955.0888 |
Chemical Identifiers
| CAS Number | 577997-11-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=CC=C(C=C4)O)C(=O)CC(C3)(C)C |
Product Overview
BAS 05946545 (CAS 577997-11-6), with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol. IUPAC: 6-(4-hydroxyphenyl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 05946545
Property Insights of BAS 05946545
The XLogP value of 5.23094 indicates that BAS 05946545 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 05946545. Following Lipinski's Rule of Five, BAS 05946545 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 05946545?
The CAS number of BAS 05946545 is 577997-11-6.
What is the molecular formula of BAS 05946545?
The molecular formula of BAS 05946545 is C23H26N2O2.
What is the molecular weight of BAS 05946545?
The molecular weight of BAS 05946545 is 362.20 g/mol.
Where can I buy BAS 05946545?
You can request a quote for BAS 05946545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05946545?
Yes, KEHONG BIO provides custom synthesis services for BAS 05946545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.