17-(4-acetylphenyl)-1-bromo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione

17-(4-acetylphenyl)-1-bromo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione

Formula: C26H18BrNO3

SMILES: CC(=O)C1=CC=C(C=C1)N1C(=O)C2C(C1=O)C1(Br)C3=C(C=CC=C3)C2C2=C1C=CC=C2

IUPAC: 17-(4-acetylphenyl)-1-bromo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione

InChI: InChI=1/C26H18BrNO3/c1-14(29)15-10-12-16(13-11-15)28-24(30)22-21-17-6-2-4-8-19(17)26(27,23(22)25(28)31)20-9-5-3-7-18(20)21/h2-13,21-23H,1H3

Composition: C (66.11%), H (3.84%), Br (16.92%), N (2.97%), O (10.16%)

Molar Mass: 472.338

Atom Count: 49

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	471.047006
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	VQORQEBVUADTIT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.53
Topological Polar Surface Area	54.45
Polarizability	45.98
Ring Count	6
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H18BrNO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00