BAS 08978536
TL;DR: BAS 08978536 (CAS 695224-35-2) is a chemical compound with molecular formula C22H21NO5 and molecular weight 379.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9,11,11-trimethyl-2,3-dioxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl) 2-methoxybenzoate
Also Known As: BAS 08978536, 4,4,6-trimethyl-1,2-dioxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-methoxybenzoate, A3376/0143266, 4,4,6-trimethyl-1,2-dioxo-2,4,5,6-tetrahydro-1H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-methoxybenzoate
| Molecular Formula | C22H21NO5 |
|---|---|
| Molecular Weight | 379.14 g/mol |
| LogP | 3.7295 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.14197 |
| Heavy Atoms | 28 |
| Complexity | 1023.58234 |
Chemical Identifiers
| CAS Number | 695224-35-2 |
|---|---|
| SMILES | CC1CC(N2C3=C1C=C(C=C3C(=O)C2=O)OC(=O)C4=CC=CC=C4OC)(C)C |
Product Overview
BAS 08978536 (CAS 695224-35-2), with molecular formula C22H21NO5 and molecular weight 379.14 g/mol. IUPAC: (9,11,11-trimethyl-2,3-dioxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl) 2-methoxybenzoate.
Chemical Property Profile of BAS 08978536
Property Insights of BAS 08978536
The XLogP value of 3.7295 indicates that BAS 08978536 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08978536. Following Lipinski's Rule of Five, BAS 08978536 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 08978536?
The CAS number of BAS 08978536 is 695224-35-2.
What is the molecular formula of BAS 08978536?
The molecular formula of BAS 08978536 is C22H21NO5.
What is the molecular weight of BAS 08978536?
The molecular weight of BAS 08978536 is 379.14 g/mol.
Where can I buy BAS 08978536?
You can request a quote for BAS 08978536 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08978536?
Yes, KEHONG BIO provides custom synthesis services for BAS 08978536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.