BAS 01251522
TL;DR: BAS 01251522 (CAS 330208-80-5) is a chemical compound with molecular formula C24H31NO5S and molecular weight 445.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanylethyl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 01251522, AB00094788-01, A1976/0083156, 2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C24H31NO5S |
|---|---|
| Molecular Weight | 445.19 g/mol |
| LogP | 4.3011 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.1923 |
| Heavy Atoms | 31 |
| Complexity | 947.2881 |
Chemical Identifiers
| CAS Number | 330208-80-5 |
|---|---|
| SMILES | CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)O)OC)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 01251522 (CAS 330208-80-5), with molecular formula C24H31NO5S and molecular weight 445.19 g/mol. IUPAC: 2-ethylsulfanylethyl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 01251522
Property Insights of BAS 01251522
The XLogP value of 4.3011 indicates that BAS 01251522 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01251522. Following Lipinski's Rule of Five, BAS 01251522 has 2 hydrogen bond donor(s) and 7 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 01251522?
The CAS number of BAS 01251522 is 330208-80-5.
What is the molecular formula of BAS 01251522?
The molecular formula of BAS 01251522 is C24H31NO5S.
What is the molecular weight of BAS 01251522?
The molecular weight of BAS 01251522 is 445.19 g/mol.
Where can I buy BAS 01251522?
You can request a quote for BAS 01251522 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01251522?
Yes, KEHONG BIO provides custom synthesis services for BAS 01251522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.