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2-({4,6-bis[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-N-(2-fluorophenyl)acetamide

2-({4,6-bis[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-N-(2-fluorophenyl)acetamide

Formula: C23H18F3N7O

SMILES: FC1=CC=C(NC2=NC(NC3=CC=C(F)C=C3)=NC(NCC(=O)NC3=CC=CC=C3F)=N2)C=C1

IUPAC: 2-({4,6-bis[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-N-(2-fluorophenyl)acetamide

InChI: InChI=1S/C23H18F3N7O/c24-14-5-9-16(10-6-14)28-22-31-21(27-13-20(34)30-19-4-2-1-3-18(19)26)32-23(33-22)29-17-11-7-15(25)8-12-17/h1-12H,13H2,(H,30,34)(H3,27,28,29,31,32,33)

Composition: C (59.35%), H (3.90%), F (12.25%), N (21.07%), O (3.44%)

Molar Mass: 465.44

Atom Count: 52

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 465.152492717
Formal Charge 0
FSP3 0.04
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 4
InChIKey JTDKMZHRFAQNAL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 124.54
Topological Polar Surface Area 103.86
Polarizability 43.84
Ring Count 4
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H18F3N7O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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