AN-979/40712141
TL;DR: AN-979/40712141 (CAS 434296-48-7) is a chemical compound with molecular formula C21H11N3O4 and molecular weight 369.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrrolo[3,4-b]pyridine-5,7-dione
Also Known As: AN-979/40712141, 6-[3-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrrolo[3,4-b]pyridine-5,7-dione
| Molecular Formula | C21H11N3O4 |
|---|---|
| Molecular Weight | 369.07 g/mol |
| LogP | 3.0506 |
| Topological Polar Surface Area | 93.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.07495 |
| Heavy Atoms | 28 |
| Complexity | 1307.8197 |
Chemical Identifiers
| CAS Number | 434296-48-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)N=CC=C5 |
Product Overview
AN-979/40712141 (CAS 434296-48-7), with molecular formula C21H11N3O4 and molecular weight 369.07 g/mol. IUPAC: 6-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]pyrrolo[3,4-b]pyridine-5,7-dione.
Chemical Property Profile of AN-979/40712141
Property Insights of AN-979/40712141
The XLogP value of 3.0506 indicates that AN-979/40712141 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-979/40712141. Following Lipinski's Rule of Five, AN-979/40712141 has 0 hydrogen bond donor(s) and 6 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 AN-979/40712141?
The CAS number of AN-979/40712141 is 434296-48-7.
What is the molecular formula of AN-979/40712141?
The molecular formula of AN-979/40712141 is C21H11N3O4.
What is the molecular weight of AN-979/40712141?
The molecular weight of AN-979/40712141 is 369.07 g/mol.
Where can I buy AN-979/40712141?
You can request a quote for AN-979/40712141 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-979/40712141?
Yes, KEHONG BIO provides custom synthesis services for AN-979/40712141 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.