BAS 02170202
TL;DR: BAS 02170202 (CAS 516456-43-2) is a chemical compound with molecular formula C28H28N2O4 and molecular weight 456.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02170202, BIM-0007400.P001, 3-(3,4-dimethoxyphenyl)-11-(4-methoxyphenyl)-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol, 9-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one, 3-(3,4-dimethoxyphenyl)-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C28H28N2O4 |
|---|---|
| Molecular Weight | 456.20 g/mol |
| LogP | 5.6919 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.2049 |
| Heavy Atoms | 34 |
| Complexity | 1249.5159 |
Chemical Identifiers
| CAS Number | 516456-43-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=CC=CC=C5N2 |
Product Overview
BAS 02170202 (CAS 516456-43-2), with molecular formula C28H28N2O4 and molecular weight 456.20 g/mol. IUPAC: 9-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02170202
Property Insights of BAS 02170202
The XLogP value of 5.6919 indicates that BAS 02170202 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02170202. Following Lipinski's Rule of Five, BAS 02170202 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02170202?
The CAS number of BAS 02170202 is 516456-43-2.
What is the molecular formula of BAS 02170202?
The molecular formula of BAS 02170202 is C28H28N2O4.
What is the molecular weight of BAS 02170202?
The molecular weight of BAS 02170202 is 456.20 g/mol.
Where can I buy BAS 02170202?
You can request a quote for BAS 02170202 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02170202?
Yes, KEHONG BIO provides custom synthesis services for BAS 02170202 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.