4-bromo-N-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzamide

4-bromo-N-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzamide

Formula: C16H13BrN2O3

SMILES: BrC1=CC=C(C=C1)C(=O)NN1C(=O)C2C3CC(C=C3)C2C1=O

IUPAC: 4-bromo-N-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}benzamide

InChI: InChI=1/C16H13BrN2O3/c17-11-5-3-8(4-6-11)14(20)18-19-15(21)12-9-1-2-10(7-9)13(12)16(19)22/h1-6,9-10,12-13H,7H2,(H,18,20)

Composition: C (53.21%), H (3.63%), Br (22.12%), N (7.76%), O (13.29%)

Molar Mass: 361.195

Atom Count: 35

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	360.010955
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RIMPTBZGDBXUFE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.8
Topological Polar Surface Area	66.48
Polarizability	31.5
Ring Count	4
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H13BrN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00