ChemDiv1_002556
TL;DR: ChemDiv1_002556 (CAS 329074-56-8) is a chemical compound with molecular formula C30H33NO6 and molecular weight 503.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(4-acetyloxy-3-ethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_002556, propan-2-yl 4-[4-(acetyloxy)-3-ethoxyphenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-ethoxy-4-{2-methyl-3-[(methylethyl)oxycarbonyl]-5-oxo-7-phenyl(4-1,4,6,7,8-p entahydroquinolyl)}phenyl acetate, isopropyl 4-(4-acetoxy-3-ethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ISOPROPYL 4-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-2-METHYL-5-OXO-7-PHENYL-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBOXYLATE
| Molecular Formula | C30H33NO6 |
|---|---|
| Molecular Weight | 503.23 g/mol |
| LogP | 5.3238 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 503.23077 |
| Heavy Atoms | 37 |
| Complexity | 1274.2317 |
Chemical Identifiers
| CAS Number | 329074-56-8 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OC(C)C)C)OC(=O)C |
Product Overview
ChemDiv1_002556 (CAS 329074-56-8), with molecular formula C30H33NO6 and molecular weight 503.23 g/mol. IUPAC: propan-2-yl 4-(4-acetyloxy-3-ethoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_002556
Property Insights of ChemDiv1_002556
The XLogP value of 5.3238 indicates that ChemDiv1_002556 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002556. Following Lipinski's Rule of Five, ChemDiv1_002556 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_002556?
The CAS number of ChemDiv1_002556 is 329074-56-8.
What is the molecular formula of ChemDiv1_002556?
The molecular formula of ChemDiv1_002556 is C30H33NO6.
What is the molecular weight of ChemDiv1_002556?
The molecular weight of ChemDiv1_002556 is 503.23 g/mol.
Where can I buy ChemDiv1_002556?
You can request a quote for ChemDiv1_002556 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002556?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002556 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.