BAS 02169877
TL;DR: BAS 02169877 (CAS 6044-67-3) is a chemical compound with molecular formula C28H28N2O3 and molecular weight 440.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-ethoxyphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02169877, BIM-0041950.P001, J2.677.149H, 11-(3-ethoxyphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 6-(3-ethoxyphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C28H28N2O3 |
|---|---|
| Molecular Weight | 440.21 g/mol |
| LogP | 6.0734 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.21 |
| Heavy Atoms | 33 |
| Complexity | 1199.7742 |
Chemical Identifiers
| CAS Number | 6044-67-3 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2 |
Product Overview
BAS 02169877 (CAS 6044-67-3), with molecular formula C28H28N2O3 and molecular weight 440.21 g/mol. IUPAC: 6-(3-ethoxyphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02169877
Property Insights of BAS 02169877
The XLogP value of 6.0734 indicates that BAS 02169877 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 02169877 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02169877 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 02169877?
The CAS number of BAS 02169877 is 6044-67-3.
What is the molecular formula of BAS 02169877?
The molecular formula of BAS 02169877 is C28H28N2O3.
What is the molecular weight of BAS 02169877?
The molecular weight of BAS 02169877 is 440.21 g/mol.
Where can I buy BAS 02169877?
You can request a quote for BAS 02169877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02169877?
Yes, KEHONG BIO provides custom synthesis services for BAS 02169877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.