2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline
TL;DR: 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline (CAS 304870-64-2) is a chemical compound with molecular formula C21H24N2O2 and molecular weight 336.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,4,6,7-pentamethyl-1-[(4-nitrophenyl)methyl]quinoline
Also Known As: BAS 00501781, 2,2,4,6,7-pentamethyl-1-[(4-nitrophenyl)methyl]quinoline, 2,2,4,6,7-pentamethyl-1-(4-nitrobenzyl)-1,2-dihydroquinoline, 2,2,4,6,7-pentamethyl-1-[(4-nitrophenyl)methyl]-1,2-dihydroquinoline, 2,2,4,6,7-Pentamethyl-1-(4-nitro-benzyl)-1,2-dihydro-quinoline
| Molecular Formula | C21H24N2O2 |
|---|---|
| Molecular Weight | 336.18 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.18378 |
| Heavy Atoms | 25 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 304870-64-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C(C=C2C)(C)C)CC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | OKOGTMJMYRRKGX-UHFFFAOYSA-N |
Product Overview
2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline (CAS 304870-64-2), with molecular formula C21H24N2O2 and molecular weight 336.18 g/mol. IUPAC: 2,2,4,6,7-pentamethyl-1-[(4-nitrophenyl)methyl]quinoline.
Chemical Property Profile of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline
Property Insights of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline
The XLogP value of 5.0 indicates that 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline has 0 hydrogen bond donor(s) and 3 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 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline?
The CAS number of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline is 304870-64-2.
What is the molecular formula of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline?
The molecular formula of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline is C21H24N2O2.
What is the molecular weight of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline?
The molecular weight of 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline is 336.18 g/mol.
Where can I buy 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline?
You can request a quote for 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4,6,7-Pentamethyl-1-[(4-nitrophenyl)methyl]quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.