AB00344119-07
TL;DR: AB00344119-07 (CAS 488107-37-5) is a chemical compound with molecular formula C18H18N2OS and molecular weight 310.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)-2-methylsulfanyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: AB00344119-07, AB00344119-08, 4-(4-methylphenyl)-2-methylsulfanyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile, 2-(methylthio)-5-oxo-4-(p-tolyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 4-(4-methylphenyl)-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
| Molecular Formula | C18H18N2OS |
|---|---|
| Molecular Weight | 310.11 g/mol |
| LogP | 3.7871 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.11398 |
| Heavy Atoms | 22 |
| Complexity | 722.4492 |
Chemical Identifiers
| CAS Number | 488107-37-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SC)C#N |
Product Overview
AB00344119-07 (CAS 488107-37-5), with molecular formula C18H18N2OS and molecular weight 310.11 g/mol. IUPAC: 4-(4-methylphenyl)-2-methylsulfanyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of AB00344119-07
Property Insights of AB00344119-07
The XLogP value of 3.7871 indicates that AB00344119-07 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, AB00344119-07 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00344119-07 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 AB00344119-07?
The CAS number of AB00344119-07 is 488107-37-5.
What is the molecular formula of AB00344119-07?
The molecular formula of AB00344119-07 is C18H18N2OS.
What is the molecular weight of AB00344119-07?
The molecular weight of AB00344119-07 is 310.11 g/mol.
Where can I buy AB00344119-07?
You can request a quote for AB00344119-07 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00344119-07?
Yes, KEHONG BIO provides custom synthesis services for AB00344119-07 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.