AO-079/15259274
TL;DR: AO-079/15259274 (CAS 63827-46-3) is a chemical compound with molecular formula C18H15N5 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-cyano-4,9,9-trimethyl-1,9a-dihydropyrrolo[3,2-b]quinolin-2-ylidene)propanedinitrile
Also Known As: AO-079/15259274, 2-(3-cyano-4,9,9-trimethyl-1,9a-dihydropyrrolo[3,2-b]quinolin-2-ylidene)propanedinitrile, 2-(3-cyano-4,9,9-trimethyl-1,4,9,9a-tetrahydro-2H-pyrrolo[3,2-b]quinolin-2-ylidene)malononitrile, 2-(3-cyano-4,9,9-trimethyl-1,9a-dihydropyrrolo[3,2-b]quinoli, (3-Cyano-4,9,9-trimethyl-1,4,9,9a-tetrahydro-2H-pyrrolo[3,2-b]quinolin-2-ylidene)propanedinitrile
| Molecular Formula | C18H15N5 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 301.13275 |
| Heavy Atoms | 23 |
| Complexity | 739.0 |
Chemical Identifiers
| CAS Number | 63827-46-3 |
|---|---|
| SMILES | CC1(C2C(=C(C(=C(C#N)C#N)N2)C#N)N(C3=CC=CC=C31)C)C |
| InChIKey | URMLGWWWKYBVDQ-UHFFFAOYSA-N |
Product Overview
AO-079/15259274 (CAS 63827-46-3), with molecular formula C18H15N5 and molecular weight 301.13 g/mol. IUPAC: 2-(3-cyano-4,9,9-trimethyl-1,9a-dihydropyrrolo[3,2-b]quinolin-2-ylidene)propanedinitrile.
Chemical Property Profile of AO-079/15259274
Property Insights of AO-079/15259274
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-079/15259274. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-079/15259274. Following Lipinski's Rule of Five, AO-079/15259274 has 1 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 AO-079/15259274?
The CAS number of AO-079/15259274 is 63827-46-3.
What is the molecular formula of AO-079/15259274?
The molecular formula of AO-079/15259274 is C18H15N5.
What is the molecular weight of AO-079/15259274?
The molecular weight of AO-079/15259274 is 301.13 g/mol.
Where can I buy AO-079/15259274?
You can request a quote for AO-079/15259274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-079/15259274?
Yes, KEHONG BIO provides custom synthesis services for AO-079/15259274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.