(5Z)-5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione

(5Z)-5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione

Formula: C18H12ClN3O6

SMILES: [O-][N+](=O)C1=CC=C(Cl)C(=C1)C1=CC=C(O1)C=C1C(=O)NC(=O)N(CC=C)C1=O

IUPAC: (5Z)-5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C18H12ClN3O6/c1-2-7-21-17(24)13(16(23)20-18(21)25)9-11-4-6-15(28-11)12-8-10(22(26)27)3-5-14(12)19/h2-6,8-9H,1,7H2,(H,20,23,25)/b13-9-

Composition: C (53.81%), H (3.01%), Cl (8.82%), N (10.46%), O (23.89%)

Molar Mass: 401.76

Atom Count: 40

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	401.0414628
Formal Charge	0
FSP3	0.06
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	GSAVRXQYVUXVNR-LCYFTJDESA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.71
Topological Polar Surface Area	122.76
Polarizability	38.02
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H12ClN3O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00