BAS 02841972
TL;DR: BAS 02841972 (CAS 6368-31-6) is a chemical compound with molecular formula C28H26N2O4 and molecular weight 454.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[9-(4-methoxyphenyl)-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-6-yl]phenyl] acetate
Also Known As: BAS 02841972, BIM-0022029.P001, 4-[3-(4-methoxyphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate, A2470/0104868, [4-[9-(4-methoxyphenyl)-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-6-yl]phenyl] acetate
| Molecular Formula | C28H26N2O4 |
|---|---|
| Molecular Weight | 454.19 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.18927 |
| Heavy Atoms | 34 |
| Complexity | 1262.3235 |
Chemical Identifiers
| CAS Number | 6368-31-6 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2 |
Product Overview
BAS 02841972 (CAS 6368-31-6), with molecular formula C28H26N2O4 and molecular weight 454.19 g/mol. IUPAC: [4-[9-(4-methoxyphenyl)-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-6-yl]phenyl] acetate.
Chemical Property Profile of BAS 02841972
Property Insights of BAS 02841972
The XLogP value of 5.6 indicates that BAS 02841972 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02841972. Following Lipinski's Rule of Five, BAS 02841972 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 02841972?
The CAS number of BAS 02841972 is 6368-31-6.
What is the molecular formula of BAS 02841972?
The molecular formula of BAS 02841972 is C28H26N2O4.
What is the molecular weight of BAS 02841972?
The molecular weight of BAS 02841972 is 454.19 g/mol.
Where can I buy BAS 02841972?
You can request a quote for BAS 02841972 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02841972?
Yes, KEHONG BIO provides custom synthesis services for BAS 02841972 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.