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

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

Formula: C24H20BrF2N7O

SMILES: CC(NC1=NC(NC2=CC=C(F)C=C2)=NC(NC2=CC=C(F)C=C2)=N1)C(=O)NC1=CC=C(Br)C=C1

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

InChI: InChI=1/C24H20BrF2N7O/c1-14(21(35)29-18-8-2-15(25)3-9-18)28-22-32-23(30-19-10-4-16(26)5-11-19)34-24(33-22)31-20-12-6-17(27)7-13-20/h2-14H,1H3,(H,29,35)(H3,28,30,31,32,33,34)

Composition: C (53.35%), H (3.73%), Br (14.79%), F (7.03%), N (18.14%), O (2.96%)

Molar Mass: 540.373

Atom Count: 55

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 1
Exact Mass 539.088078
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 4
InChIKey FTLOJXRNCDLNKP-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 136.44
Topological Polar Surface Area 103.86
Polarizability 48.8
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H20BrF2N7O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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