10-(4-fluorophenyl)-12-(4-methoxybenzoyl)-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0²,?]trideca-2(7),3,5-trien-11-one

10-(4-fluorophenyl)-12-(4-methoxybenzoyl)-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0²,?]trideca-2(7),3,5-trien-11-one

Formula: C25H21FN2O4

SMILES: COC1=CC=C(C=C1)C(=O)N1C2CC(C)(OC3=C2C=CC=C3)N(C1=O)C1=CC=C(F)C=C1

IUPAC: 10-(4-fluorophenyl)-12-(4-methoxybenzoyl)-9-methyl-8-oxa-10,12-diazatricyclo[7.3.1.0²,?]trideca-2(7),3,5-trien-11-one

InChI: InChI=1/C25H21FN2O4/c1-25-15-21(20-5-3-4-6-22(20)32-25)27(23(29)16-7-13-19(31-2)14-8-16)24(30)28(25)18-11-9-17(26)10-12-18/h3-14,21H,15H2,1-2H3

Composition: C (69.44%), H (4.89%), F (4.39%), N (6.48%), O (14.80%)

Molar Mass: 432.451

Atom Count: 53

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	432.148535327
Formal Charge	0
FSP3	0.2
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	ZIQCKIBAUUBRGU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.55
Topological Polar Surface Area	59.08
Polarizability	44.16
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H21FN2O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00