AB00099757-01
TL;DR: AB00099757-01 (CAS 5866-87-5) is a chemical compound with molecular formula C25H24ClNO5 and molecular weight 453.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: AB00099757-01, cyclopentyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclopentyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, cyclopentyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, Cyclopentyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C25H24ClNO5 |
|---|---|
| Molecular Weight | 453.13 g/mol |
| LogP | 4.9001 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 453.1343 |
| Heavy Atoms | 32 |
| Complexity | 1248.7009 |
Chemical Identifiers
| CAS Number | 5866-87-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OC5CCCC5 |
Product Overview
AB00099757-01 (CAS 5866-87-5), with molecular formula C25H24ClNO5 and molecular weight 453.13 g/mol. IUPAC: cyclopentyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of AB00099757-01
Property Insights of AB00099757-01
The XLogP value of 4.9001 indicates that AB00099757-01 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 AB00099757-01. Following Lipinski's Rule of Five, AB00099757-01 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 AB00099757-01?
The CAS number of AB00099757-01 is 5866-87-5.
What is the molecular formula of AB00099757-01?
The molecular formula of AB00099757-01 is C25H24ClNO5.
What is the molecular weight of AB00099757-01?
The molecular weight of AB00099757-01 is 453.13 g/mol.
Where can I buy AB00099757-01?
You can request a quote for AB00099757-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00099757-01?
Yes, KEHONG BIO provides custom synthesis services for AB00099757-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.