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(5E)-1-(4-fluorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

(5E)-1-(4-fluorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

Formula: C18H13FN2O3S

SMILES: CSC1=CC=C(C=C2/C(=O)NC(=O)N(C2=O)C2=CC=C(F)C=C2)C=C1

IUPAC: (5E)-1-(4-fluorophenyl)-5-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C18H13FN2O3S/c1-25-14-8-2-11(3-9-14)10-15-16(22)20-18(24)21(17(15)23)13-6-4-12(19)5-7-13/h2-10H,1H3,(H,20,22,24)/b15-10+

Composition: C (60.67%), H (3.68%), F (5.33%), N (7.86%), O (13.47%), S (9.00%)

Molar Mass: 356.37

Atom Count: 38

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 356.063091624
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RORAQTQXGKVNRY-XNTDXEJSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.77
Topological Polar Surface Area 66.48
Polarizability 35.21
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H13FN2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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