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(5Z)-5-{[(4-chloro-2-nitrophenyl)amino]methylidene}-1-(3-chlorophenyl)-1,3-diazinane-2,4,6-trione

(5Z)-5-{[(4-chloro-2-nitrophenyl)amino]methylidene}-1-(3-chlorophenyl)-1,3-diazinane-2,4,6-trione

Formula: C17H10Cl2N4O5

SMILES: [O-][N+](=O)C1=CC(Cl)=CC=C1NC=C1C(=O)NC(=O)N(C1=O)C1=CC=CC(Cl)=C1

IUPAC: (5Z)-5-{[(4-chloro-2-nitrophenyl)amino]methylidene}-1-(3-chlorophenyl)-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C17H10Cl2N4O5/c18-9-2-1-3-11(6-9)22-16(25)12(15(24)21-17(22)26)8-20-13-5-4-10(19)7-14(13)23(27)28/h1-8,20H,(H,21,24,26)/b12-8-

Composition: C (48.48%), H (2.39%), Cl (16.83%), N (13.30%), O (18.99%)

Molar Mass: 421.19

Atom Count: 38

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 420.0028248
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey KNWSYLFSWRBILW-WQLSENKSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.93
Topological Polar Surface Area 121.65
Polarizability 37.61
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H10Cl2N4O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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