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

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

Formula: C27H25BrN2O3

SMILES: COC1=CC=C(C=C1)C1CC(=O)C2=C(C1)NC1=CC=CC=C1NC2C1=CC=C(OC)C(Br)=C1

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

InChI: InChI=1/C27H25BrN2O3/c1-32-19-10-7-16(8-11-19)18-14-23-26(24(31)15-18)27(17-9-12-25(33-2)20(28)13-17)30-22-6-4-3-5-21(22)29-23/h3-13,18,27,29-30H,14-15H2,1-2H3

Composition: C (64.16%), H (4.99%), Br (15.81%), N (5.54%), O (9.50%)

Molar Mass: 505.412

Atom Count: 58

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	504.104856
Formal Charge	0
FSP3	0.22
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	SGGAWTSJKHFBAW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	136.92
Topological Polar Surface Area	59.59
Polarizability	50.78
Ring Count	5
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H25BrN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00