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

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

Formula: C26H21BrN2O2

SMILES: BrC1=CC=C(C=C1)C1NC2=CC=C(C=C2NC2=C1C(=O)CCC2)C(=O)C1=CC=CC=C1

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

InChI: InChI=1/C26H21BrN2O2/c27-19-12-9-16(10-13-19)25-24-21(7-4-8-23(24)30)28-22-15-18(11-14-20(22)29-25)26(31)17-5-2-1-3-6-17/h1-3,5-6,9-15,25,28-29H,4,7-8H2

Composition: C (65.97%), H (4.47%), Br (16.88%), N (5.92%), O (6.76%)

Molar Mass: 473.37

Atom Count: 52

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	472.078641
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	BLTQWCYDKFPJBZ-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	129.92
Topological Polar Surface Area	58.2
Polarizability	47.78
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H21BrN2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00