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

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

Formula: C29H33N7O2

SMILES: COC1=CC=CC(NC(=O)C(C)NC2=NC(NC3=CC=C(C)C=C3C)=NC(NC3=CC=C(C)C=C3C)=N2)=C1

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

InChI: InChI=1/C29H33N7O2/c1-17-10-12-24(19(3)14-17)32-28-34-27(35-29(36-28)33-25-13-11-18(2)15-20(25)4)30-21(5)26(37)31-22-8-7-9-23(16-22)38-6/h7-16,21H,1-6H3,(H,31,37)(H3,30,32,33,34,35,36)

Composition: C (68.08%), H (6.50%), N (19.16%), O (6.25%)

Molar Mass: 511.63

Atom Count: 71

Heavy Atom Count: 38

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 1
Exact Mass 511.269573331
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 4
InChIKey QORPQEPGPMGXOM-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 155.01
Topological Polar Surface Area 113.09
Polarizability 56.13
Ring Count 4
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C29H33N7O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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