BAS 02169986
TL;DR: BAS 02169986 (CAS 5885-20-1) is a chemical compound with molecular formula C23H22ClNO5 and molecular weight 427.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 02169986, AB00100334-01, propan-2-yl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, isopropyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, isopropyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C23H22ClNO5 |
|---|---|
| Molecular Weight | 427.12 g/mol |
| LogP | 4.3659 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 427.11865 |
| Heavy Atoms | 30 |
| Complexity | 1187.7869 |
Chemical Identifiers
| CAS Number | 5885-20-1 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OC(C)C |
Product Overview
BAS 02169986 (CAS 5885-20-1), with molecular formula C23H22ClNO5 and molecular weight 427.12 g/mol. IUPAC: propan-2-yl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 02169986
Property Insights of BAS 02169986
The XLogP value of 4.3659 indicates that BAS 02169986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02169986. Following Lipinski's Rule of Five, BAS 02169986 has 1 hydrogen bond donor(s) and 6 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 02169986?
The CAS number of BAS 02169986 is 5885-20-1.
What is the molecular formula of BAS 02169986?
The molecular formula of BAS 02169986 is C23H22ClNO5.
What is the molecular weight of BAS 02169986?
The molecular weight of BAS 02169986 is 427.12 g/mol.
Where can I buy BAS 02169986?
You can request a quote for BAS 02169986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02169986?
Yes, KEHONG BIO provides custom synthesis services for BAS 02169986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.