14-(4-chlorophenyl)-10-[2-(trifluoromethyl)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

14-(4-chlorophenyl)-10-[2-(trifluoromethyl)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

Formula: C26H20ClF3N2O

SMILES: FC(F)(F)C1=CC=CC=C1C1NC2=CC=CC=C2NC2=C1C(=O)CC(C2)C1=CC=C(Cl)C=C1

IUPAC: 14-(4-chlorophenyl)-10-[2-(trifluoromethyl)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

InChI: InChI=1/C26H20ClF3N2O/c27-17-11-9-15(10-12-17)16-13-22-24(23(33)14-16)25(32-21-8-4-3-7-20(21)31-22)18-5-1-2-6-19(18)26(28,29)30/h1-12,16,25,31-32H,13-14H2

Composition: C (66.60%), H (4.30%), Cl (7.56%), F (12.15%), N (5.97%), O (3.41%)

Molar Mass: 468.9

Atom Count: 53

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	468.1216255
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ZJXKQRGEILBXMA-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	127.15
Topological Polar Surface Area	41.13
Polarizability	45.88
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H20ClF3N2O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00