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

Formula: C24H14ClN3O6

SMILES: [O-][N+](=O)C1=CC(Cl)=CC=C1N1C(=O)C2C(C1=O)C1(C3=C(C=CC=C3)C2C2=C1C=CC=C2)[N+]([O-])=O

IUPAC: 17-(4-chloro-2-nitrophenyl)-1-nitro-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/C24H14ClN3O6/c25-12-9-10-17(18(11-12)27(31)32)26-22(29)20-19-13-5-1-3-7-15(13)24(28(33)34,21(20)23(26)30)16-8-4-2-6-14(16)19/h1-11,19-21H

Composition: C (60.58%), H (2.97%), Cl (7.45%), N (8.83%), O (20.17%)

Molar Mass: 475.84

Atom Count: 48

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	475.0571129
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	OVKIGWJWZJTXOL-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	118.54
Topological Polar Surface Area	123.66
Polarizability	45.38
Ring Count	6
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H14ClN3O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00