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

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

Formula: C28H31N7O2

SMILES: CCC1=CC=C(NC2=NC(NC3=CC=C(CC)C=C3)=NC(NCC(=O)NC3=CC=C(OC)C=C3)=N2)C=C1

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

InChI: InChI=1S/C28H31N7O2/c1-4-19-6-10-22(11-7-19)31-27-33-26(29-18-25(36)30-21-14-16-24(37-3)17-15-21)34-28(35-27)32-23-12-8-20(5-2)9-13-23/h6-17H,4-5,18H2,1-3H3,(H,30,36)(H3,29,31,32,33,34,35)

Composition: C (67.59%), H (6.28%), N (19.70%), O (6.43%)

Molar Mass: 497.603

Atom Count: 68

Heavy Atom Count: 37

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 497.253923266
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 4
InChIKey SHVQNNZYRVRYHI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 149.64
Topological Polar Surface Area 113.09
Polarizability 54.44
Ring Count 4
Rotatable Bond Count 11

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H31N7O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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