ChemDiv1_002279
TL;DR: ChemDiv1_002279 (CAS 306286-04-4) is a chemical compound with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(diethylamino)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: ChemDiv1_002279, BAS 01251355, AB00094770-01, 4-[4-(diethylamino)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 4-[4-(diethylamino)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
| Molecular Formula | C28H31N3O2 |
|---|---|
| Molecular Weight | 441.24 g/mol |
| LogP | 5.42658 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.24164 |
| Heavy Atoms | 33 |
| Complexity | 1133.1602 |
Chemical Identifiers
| CAS Number | 306286-04-4 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CC(C3)C4=CC=C(C=C4)OC)C)C#N |
Product Overview
ChemDiv1_002279 (CAS 306286-04-4), with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol. IUPAC: 4-[4-(diethylamino)phenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of ChemDiv1_002279
Property Insights of ChemDiv1_002279
The XLogP value of 5.42658 indicates that ChemDiv1_002279 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002279. Following Lipinski's Rule of Five, ChemDiv1_002279 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002279?
The CAS number of ChemDiv1_002279 is 306286-04-4.
What is the molecular formula of ChemDiv1_002279?
The molecular formula of ChemDiv1_002279 is C28H31N3O2.
What is the molecular weight of ChemDiv1_002279?
The molecular weight of ChemDiv1_002279 is 441.24 g/mol.
Where can I buy ChemDiv1_002279?
You can request a quote for ChemDiv1_002279 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002279?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002279 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.