AE-641/11948059
TL;DR: AE-641/11948059 (CAS 342046-30-4) is a chemical compound with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxy-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
Also Known As: AE-641/11948059, 4-(3-hydroxy-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarbonitrile, 1,4-Dihydro-4-(3-hydroxy-4-methoxyphenyl)-2,6-dimethyl-3,5-pyridinedicarbonitrile, 4-(3-hydroxy-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile, 4-(3-hydroxy-4-methoxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
| Molecular Formula | C16H15N3O2 |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 2.68276 |
| Topological Polar Surface Area | 89.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.11642 |
| Heavy Atoms | 21 |
| Complexity | 696.86945 |
Chemical Identifiers
| CAS Number | 342046-30-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C#N)C2=CC(=C(C=C2)OC)O)C#N |
Product Overview
AE-641/11948059 (CAS 342046-30-4), with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol. IUPAC: 4-(3-hydroxy-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile.
Chemical Property Profile of AE-641/11948059
Property Insights of AE-641/11948059
The XLogP value of 2.68276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AE-641/11948059. The TPSA of 89.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-641/11948059. Following Lipinski's Rule of Five, AE-641/11948059 has 2 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 AE-641/11948059?
The CAS number of AE-641/11948059 is 342046-30-4.
What is the molecular formula of AE-641/11948059?
The molecular formula of AE-641/11948059 is C16H15N3O2.
What is the molecular weight of AE-641/11948059?
The molecular weight of AE-641/11948059 is 281.12 g/mol.
Where can I buy AE-641/11948059?
You can request a quote for AE-641/11948059 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/11948059?
Yes, KEHONG BIO provides custom synthesis services for AE-641/11948059 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.