ChemDiv1_003242
TL;DR: ChemDiv1_003242 (CAS 312598-86-0) is a chemical compound with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenoxyethyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_003242, 2-phenoxyethyl 4-(6-chloro-4-oxo-4H-chromen-3-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenoxyethyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-1,4,6,7,8-pentahy droquinoline-3-carboxylate, 2-phenoxyethyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C28H24ClNO6 |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 5.0365 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.1292 |
| Heavy Atoms | 36 |
| Complexity | 1470.3882 |
Chemical Identifiers
| CAS Number | 312598-86-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OCCOC5=CC=CC=C5 |
Product Overview
ChemDiv1_003242 (CAS 312598-86-0), with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol. IUPAC: 2-phenoxyethyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_003242
Property Insights of ChemDiv1_003242
The XLogP value of 5.0365 indicates that ChemDiv1_003242 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_003242. Following Lipinski's Rule of Five, ChemDiv1_003242 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_003242?
The CAS number of ChemDiv1_003242 is 312598-86-0.
What is the molecular formula of ChemDiv1_003242?
The molecular formula of ChemDiv1_003242 is C28H24ClNO6.
What is the molecular weight of ChemDiv1_003242?
The molecular weight of ChemDiv1_003242 is 505.13 g/mol.
Where can I buy ChemDiv1_003242?
You can request a quote for ChemDiv1_003242 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003242?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003242 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.