BAS 09588845
TL;DR: BAS 09588845 (CAS 423139-85-9) is a chemical compound with molecular formula C24H30N2O3S and molecular weight 426.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7,7-trimethyl-4-(4-methylsulfanylphenyl)-3-(morpholine-4-carbonyl)-1,4,6,8-tetrahydroquinolin-5-one
Also Known As: BAS 09588845, 2,7,7-trimethyl-4-(4-methylsulfanylphenyl)-3-(morpholine-4-carbonyl)-1,4,6,8-tetrahydroquinolin-5-one, 2,7,7-trimethyl-4-(4-methylthiophenyl)-3-(morpholin-4-ylcarbonyl)-1,4,6,7,8-pe ntahydroquinolin-5-one, 2,7,7-trimethyl-4-[4-(methylsulfanyl)phenyl]-3-(morpholin-4-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one, 2,7,7-TRIMETHYL-4-[4-(METHYLSULFANYL)PHENYL]-3-(MORPHOLINE-4-CARBONYL)-1,4,5,6,7,8-HEXAHYDROQUINOLIN-5-ONE
| Molecular Formula | C24H30N2O3S |
|---|---|
| Molecular Weight | 426.20 g/mol |
| LogP | 3.8713 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.19772 |
| Heavy Atoms | 30 |
| Complexity | 924.27435 |
Chemical Identifiers
| CAS Number | 423139-85-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)SC)C(=O)N4CCOCC4 |
Product Overview
BAS 09588845 (CAS 423139-85-9), with molecular formula C24H30N2O3S and molecular weight 426.20 g/mol. IUPAC: 2,7,7-trimethyl-4-(4-methylsulfanylphenyl)-3-(morpholine-4-carbonyl)-1,4,6,8-tetrahydroquinolin-5-one.
Chemical Property Profile of BAS 09588845
Property Insights of BAS 09588845
The XLogP value of 3.8713 indicates that BAS 09588845 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 09588845 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 09588845 has 1 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 BAS 09588845?
The CAS number of BAS 09588845 is 423139-85-9.
What is the molecular formula of BAS 09588845?
The molecular formula of BAS 09588845 is C24H30N2O3S.
What is the molecular weight of BAS 09588845?
The molecular weight of BAS 09588845 is 426.20 g/mol.
Where can I buy BAS 09588845?
You can request a quote for BAS 09588845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09588845?
Yes, KEHONG BIO provides custom synthesis services for BAS 09588845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.