BAS 02590055
TL;DR: BAS 02590055 (CAS 309732-12-5) is a chemical compound with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-chlorophenyl)-3-cyano-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide
Also Known As: BAS 02590055, AB01307781-01, 2-{[4-(4-chlorophenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide, 2-((4-(4-chlorophenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(4-ethoxyphenyl)acetamide, F0763-0078
| Molecular Formula | C26H24ClN3O3S |
|---|---|
| Molecular Weight | 493.12 g/mol |
| LogP | 5.53968 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.12268 |
| Heavy Atoms | 34 |
| Complexity | 1197.2917 |
Chemical Identifiers
| CAS Number | 309732-12-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=C(C=C4)Cl)C#N |
Product Overview
BAS 02590055 (CAS 309732-12-5), with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-3-cyano-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide.
Chemical Property Profile of BAS 02590055
Property Insights of BAS 02590055
The XLogP value of 5.53968 indicates that BAS 02590055 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02590055. Following Lipinski's Rule of Five, BAS 02590055 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02590055?
The CAS number of BAS 02590055 is 309732-12-5.
What is the molecular formula of BAS 02590055?
The molecular formula of BAS 02590055 is C26H24ClN3O3S.
What is the molecular weight of BAS 02590055?
The molecular weight of BAS 02590055 is 493.12 g/mol.
Where can I buy BAS 02590055?
You can request a quote for BAS 02590055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02590055?
Yes, KEHONG BIO provides custom synthesis services for BAS 02590055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.