(5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(4-chloro-3-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione

(5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(4-chloro-3-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione

Formula: C18H10ClN3O7

SMILES: [O-][N+](=O)C1=CC(C=C2/C(=O)NC(=O)N(C2=O)C2=CC=C3OCOC3=C2)=CC=C1Cl

IUPAC: (5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(4-chloro-3-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C18H10ClN3O7/c19-12-3-1-9(6-13(12)22(26)27)5-11-16(23)20-18(25)21(17(11)24)10-2-4-14-15(7-10)29-8-28-14/h1-7H,8H2,(H,20,23,25)/b11-5+

Composition: C (52.00%), H (2.42%), Cl (8.53%), N (10.11%), O (26.94%)

Molar Mass: 415.74

Atom Count: 39

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	415.0207274
Formal Charge	0
FSP3	0.06
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	OZQWBLYMDZHVTN-VZUCSPMQSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.69
Topological Polar Surface Area	128.08
Polarizability	37.12
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H10ClN3O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00