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

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

Formula: C26H27N7O

SMILES: CC1=CC=C(NC2=NC(NC3=CC=C(C)C=C3)=NC(NCC(=O)NC3=CC=CC=C3C)=N2)C=C1

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

InChI: InChI=1S/C26H27N7O/c1-17-8-12-20(13-9-17)28-25-31-24(27-16-23(34)30-22-7-5-4-6-19(22)3)32-26(33-25)29-21-14-10-18(2)11-15-21/h4-15H,16H2,1-3H3,(H,30,34)(H3,27,28,29,31,32,33)

Composition: C (68.85%), H (6.00%), N (21.62%), O (3.53%)

Molar Mass: 453.55

Atom Count: 61

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 453.227708517
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 4
InChIKey IUPSODABARYOLI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 139.01
Topological Polar Surface Area 103.86
Polarizability 50.01
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 C26H27N7O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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