Text Search
Structure Search

2-(3-nitrophenyl)-2-oxoethyl 7-chloro-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

2-(3-nitrophenyl)-2-oxoethyl 7-chloro-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Formula: C26H19ClN2O5

SMILES: CC1=CC=C(C=C1)C1=NC2=C(C)C(Cl)=CC=C2C(=C1)C(=O)OCC(=O)C1=CC=CC(=C1)[N+]([O-])=O

IUPAC: 2-(3-nitrophenyl)-2-oxoethyl 7-chloro-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

InChI: InChI=1S/C26H19ClN2O5/c1-15-6-8-17(9-7-15)23-13-21(20-10-11-22(27)16(2)25(20)28-23)26(31)34-14-24(30)18-4-3-5-19(12-18)29(32)33/h3-13H,14H2,1-2H3

Composition: C (65.76%), H (4.03%), Cl (7.46%), N (5.90%), O (16.84%)

Molar Mass: 474.9

Atom Count: 53

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 474.0982494
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey BMECULKVPCEXEO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 127.88
Topological Polar Surface Area 99.4
Polarizability 51.05
Ring Count 4
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H19ClN2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote