ChemDiv1_002179
TL;DR: ChemDiv1_002179 (CAS 330848-74-3) is a chemical compound with molecular formula C32H37NO6 and molecular weight 531.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: ChemDiv1_002179, BAS 01052092, oxolan-2-ylmethyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, tetrahydro-2-furanylmethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, tetrahydrofuran-2-ylmethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C32H37NO6 |
|---|---|
| Molecular Weight | 531.26 g/mol |
| LogP | 5.6004 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 531.2621 |
| Heavy Atoms | 39 |
| Complexity | 1303.1942 |
Chemical Identifiers
| CAS Number | 330848-74-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OCC5CCCO5 |
Product Overview
ChemDiv1_002179 (CAS 330848-74-3), with molecular formula C32H37NO6 and molecular weight 531.26 g/mol. IUPAC: oxolan-2-ylmethyl 4-(3-methoxy-4-phenylmethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_002179
Property Insights of ChemDiv1_002179
The XLogP value of 5.6004 indicates that ChemDiv1_002179 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002179. Following Lipinski's Rule of Five, ChemDiv1_002179 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_002179?
The CAS number of ChemDiv1_002179 is 330848-74-3.
What is the molecular formula of ChemDiv1_002179?
The molecular formula of ChemDiv1_002179 is C32H37NO6.
What is the molecular weight of ChemDiv1_002179?
The molecular weight of ChemDiv1_002179 is 531.26 g/mol.
Where can I buy ChemDiv1_002179?
You can request a quote for ChemDiv1_002179 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002179?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002179 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.