ChemDiv1_004149
TL;DR: ChemDiv1_004149 (CAS 304451-38-5) is a chemical compound with molecular formula C28H31NO7 and molecular weight 493.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,7-bis(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_004149, BAS 02170153, BIM-0002116.P001, methyl 4,7-bis(3,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, A2438/0103330
| Molecular Formula | C28H31NO7 |
|---|---|
| Molecular Weight | 493.21 g/mol |
| LogP | 4.2556 |
| Topological Polar Surface Area | 92.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 493.21005 |
| Heavy Atoms | 36 |
| Complexity | 1260.5397 |
Chemical Identifiers
| CAS Number | 304451-38-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)C4=CC(=C(C=C4)OC)OC)C(=O)OC |
Product Overview
ChemDiv1_004149 (CAS 304451-38-5), with molecular formula C28H31NO7 and molecular weight 493.21 g/mol. IUPAC: methyl 4,7-bis(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_004149
Property Insights of ChemDiv1_004149
The XLogP value of 4.2556 indicates that ChemDiv1_004149 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.32 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004149. Following Lipinski's Rule of Five, ChemDiv1_004149 has 1 hydrogen bond donor(s) and 8 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 ChemDiv1_004149?
The CAS number of ChemDiv1_004149 is 304451-38-5.
What is the molecular formula of ChemDiv1_004149?
The molecular formula of ChemDiv1_004149 is C28H31NO7.
What is the molecular weight of ChemDiv1_004149?
The molecular weight of ChemDiv1_004149 is 493.21 g/mol.
Where can I buy ChemDiv1_004149?
You can request a quote for ChemDiv1_004149 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004149?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004149 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.