AB01099358-02
TL;DR: AB01099358-02 (CAS 488852-10-4) is a chemical compound with molecular formula C19H20N2OS and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: AB01099358-02, 2-(ethylsulfanyl)-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-ethylsulfanyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile, 2-(ethylsulfanyl)-5-hydroxy-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile, 2-(ethylthio)-5-oxo-4-(p-tolyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
| Molecular Formula | C19H20N2OS |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 4.1772 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.12964 |
| Heavy Atoms | 23 |
| Complexity | 737.6283 |
Chemical Identifiers
| CAS Number | 488852-10-4 |
|---|---|
| SMILES | CCSC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)C)C#N |
Product Overview
AB01099358-02 (CAS 488852-10-4), with molecular formula C19H20N2OS and molecular weight 324.13 g/mol. IUPAC: 2-ethylsulfanyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of AB01099358-02
Property Insights of AB01099358-02
The XLogP value of 4.1772 indicates that AB01099358-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, AB01099358-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01099358-02 has 1 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 AB01099358-02?
The CAS number of AB01099358-02 is 488852-10-4.
What is the molecular formula of AB01099358-02?
The molecular formula of AB01099358-02 is C19H20N2OS.
What is the molecular weight of AB01099358-02?
The molecular weight of AB01099358-02 is 324.13 g/mol.
Where can I buy AB01099358-02?
You can request a quote for AB01099358-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01099358-02?
Yes, KEHONG BIO provides custom synthesis services for AB01099358-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.