ChemDiv1_008176
TL;DR: ChemDiv1_008176 (CAS 5804-29-5) 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.
oxolan-2-ylmethyl 4-(4-methoxy-3-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_008176, DivK1c_002816, CDS1_001776, oxolan-2-ylmethyl 4-(4-methoxy-3-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, A2557/0108922
| Molecular Formula | C30H33NO6 |
|---|---|
| Molecular Weight | 503.23 g/mol |
| LogP | 4.9643 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.23077 |
| Heavy Atoms | 37 |
| Complexity | 1225.8876 |
Chemical Identifiers
| CAS Number | 5804-29-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)OCC4=CC=CC=C4)C(=O)OCC5CCCO5 |
Product Overview
ChemDiv1_008176 (CAS 5804-29-5), with molecular formula C30H33NO6 and molecular weight 503.23 g/mol. IUPAC: oxolan-2-ylmethyl 4-(4-methoxy-3-phenylmethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_008176
Property Insights of ChemDiv1_008176
The XLogP value of 4.9643 indicates that ChemDiv1_008176 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_008176. Following Lipinski's Rule of Five, ChemDiv1_008176 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_008176?
The CAS number of ChemDiv1_008176 is 5804-29-5.
What is the molecular formula of ChemDiv1_008176?
The molecular formula of ChemDiv1_008176 is C30H33NO6.
What is the molecular weight of ChemDiv1_008176?
The molecular weight of ChemDiv1_008176 is 503.23 g/mol.
Where can I buy ChemDiv1_008176?
You can request a quote for ChemDiv1_008176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008176?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.