3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone
TL;DR: 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone (CAS 180693-49-6) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone
Also Known As: 1-{5-Nitro-2-furoyl}, BAS 00315380, 1-{5-nitro-2-furoyl}-1,2,3,4-tetrahydroquinoline, 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone, 5-nitro(2-furyl) 1,2,3,4-tetrahydroquinolyl ketone
| Molecular Formula | C14H12N2O4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.0797 |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 180693-49-6 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | NBVMTQCFEVQJNA-UHFFFAOYSA-N |
Product Overview
3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone (CAS 180693-49-6), with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol. IUPAC: 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone.
Chemical Property Profile of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone
Property Insights of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone. Following Lipinski's Rule of Five, 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone has 0 hydrogen bond donor(s) and 4 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 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone?
The CAS number of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone is 180693-49-6.
What is the molecular formula of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone?
The molecular formula of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone is C14H12N2O4.
What is the molecular weight of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone?
The molecular weight of 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone is 272.08 g/mol.
Where can I buy 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone?
You can request a quote for 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydro-2H-quinolin-1-yl-(5-nitrofuran-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.