BAS 01251531
TL;DR: BAS 01251531 (CAS 330208-87-2) is a chemical compound with molecular formula C28H30ClNO5 and molecular weight 495.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01251531, propan-2-yl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, isopropyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methylethyl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4 ,6,7,8-pentahydroquinoline-3-carboxylate, propan-2-yl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C28H30ClNO5 |
|---|---|
| Molecular Weight | 495.18 g/mol |
| LogP | 5.7575 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.18124 |
| Heavy Atoms | 35 |
| Complexity | 1212.3535 |
Chemical Identifiers
| CAS Number | 330208-87-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OC(C)C)C)O |
Product Overview
BAS 01251531 (CAS 330208-87-2), with molecular formula C28H30ClNO5 and molecular weight 495.18 g/mol. IUPAC: propan-2-yl 7-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01251531
Property Insights of BAS 01251531
The XLogP value of 5.7575 indicates that BAS 01251531 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 01251531. Following Lipinski's Rule of Five, BAS 01251531 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 01251531?
The CAS number of BAS 01251531 is 330208-87-2.
What is the molecular formula of BAS 01251531?
The molecular formula of BAS 01251531 is C28H30ClNO5.
What is the molecular weight of BAS 01251531?
The molecular weight of BAS 01251531 is 495.18 g/mol.
Where can I buy BAS 01251531?
You can request a quote for BAS 01251531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01251531?
Yes, KEHONG BIO provides custom synthesis services for BAS 01251531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.