N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-2-phenylquinoline-4-carboxamide

N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-2-phenylquinoline-4-carboxamide

Formula: C31H31N3O2

SMILES: CC1=CC=CC(C)=C1NC(=O)C1(CCCCC1)NC(=O)C1=CC(=NC2=CC=CC=C12)C1=CC=CC=C1

IUPAC: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-2-phenylquinoline-4-carboxamide

InChI: InChI=1S/C31H31N3O2/c1-21-12-11-13-22(2)28(21)33-30(36)31(18-9-4-10-19-31)34-29(35)25-20-27(23-14-5-3-6-15-23)32-26-17-8-7-16-24(25)26/h3,5-8,11-17,20H,4,9-10,18-19H2,1-2H3,(H,33,36)(H,34,35)

Composition: C (77.96%), H (6.54%), N (8.80%), O (6.70%)

Molar Mass: 477.608

Atom Count: 67

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	477.24162725
Formal Charge	0
FSP3	0.26
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	JUEXJHPMUZTPHN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	144.22
Topological Polar Surface Area	71.09
Polarizability	57.31
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C31H31N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00