BAS 01279654
TL;DR: BAS 01279654 (CAS 184530-23-2) is a chemical compound with molecular formula C18H16N4OS and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile
Also Known As: BAS 01279654, BIM-0014024.P001, 2-amino-4-ethyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile, 2-amino-4-ethyl-6-{[2-(4-methylphenyl)-2-oxoethyl]thio}-3,5-pyridinedicarbonitrile, 2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile
| Molecular Formula | C18H16N4OS |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.1045 |
| Heavy Atoms | 24 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 184530-23-2 |
|---|---|
| SMILES | CCC1=C(C(=NC(=C1C#N)SCC(=O)C2=CC=C(C=C2)C)N)C#N |
| InChIKey | KMHAILNWUHLBEA-UHFFFAOYSA-N |
Product Overview
BAS 01279654 (CAS 184530-23-2), with molecular formula C18H16N4OS and molecular weight 336.10 g/mol. IUPAC: 2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile.
Chemical Property Profile of BAS 01279654
Property Insights of BAS 01279654
The XLogP value of 3.9 indicates that BAS 01279654 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01279654. Following Lipinski's Rule of Five, BAS 01279654 has 1 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 BAS 01279654?
The CAS number of BAS 01279654 is 184530-23-2.
What is the molecular formula of BAS 01279654?
The molecular formula of BAS 01279654 is C18H16N4OS.
What is the molecular weight of BAS 01279654?
The molecular weight of BAS 01279654 is 336.10 g/mol.
Where can I buy BAS 01279654?
You can request a quote for BAS 01279654 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01279654?
Yes, KEHONG BIO provides custom synthesis services for BAS 01279654 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.