AB00090347-01
TL;DR: AB00090347-01 (CAS 264255-02-9) is a chemical compound with molecular formula C15H14N2O2S and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxyphenyl)-2-oxo-6-prop-2-enylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile
Also Known As: AB00090347-01, AE-848/11827113, 4-(3-hydroxyphenyl)-2-oxo-6-prop-2-enylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile, 2-(allylsulfanyl)-4-(3-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarbonitrile, 2-(allylthio)-4-(3-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
| Molecular Formula | C15H14N2O2S |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 2.65008 |
| Topological Polar Surface Area | 73.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.0776 |
| Heavy Atoms | 20 |
| Complexity | 616.5447 |
Chemical Identifiers
| CAS Number | 264255-02-9 |
|---|---|
| SMILES | C=CCSC1=C(C(CC(=O)N1)C2=CC(=CC=C2)O)C#N |
Product Overview
AB00090347-01 (CAS 264255-02-9), with molecular formula C15H14N2O2S and molecular weight 286.08 g/mol. IUPAC: 4-(3-hydroxyphenyl)-2-oxo-6-prop-2-enylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile.
Chemical Property Profile of AB00090347-01
Property Insights of AB00090347-01
The XLogP value of 2.65008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00090347-01. The TPSA of 73.12 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00090347-01. Following Lipinski's Rule of Five, AB00090347-01 has 2 hydrogen bond donor(s) and 4 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 AB00090347-01?
The CAS number of AB00090347-01 is 264255-02-9.
What is the molecular formula of AB00090347-01?
The molecular formula of AB00090347-01 is C15H14N2O2S.
What is the molecular weight of AB00090347-01?
The molecular weight of AB00090347-01 is 286.08 g/mol.
Where can I buy AB00090347-01?
You can request a quote for AB00090347-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00090347-01?
Yes, KEHONG BIO provides custom synthesis services for AB00090347-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.