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2-{[(4-methoxyphenyl)methyl]amino}-2-phenyl-N-(1,3-thiazol-2-yl)acetamide

2-{[(4-methoxyphenyl)methyl]amino}-2-phenyl-N-(1,3-thiazol-2-yl)acetamide

CAS: 1031209-53-6

Formula: C19H19N3O2S

SMILES: COC1=CC=C(CNC(C(=O)NC2=NC=CS2)C2=CC=CC=C2)C=C1

IUPAC: 2-{[(4-methoxyphenyl)methyl]amino}-2-phenyl-N-(1,3-thiazol-2-yl)acetamide

InChI: InChI=1/C19H19N3O2S/c1-24-16-9-7-14(8-10-16)13-21-17(15-5-3-2-4-6-15)18(23)22-19-20-11-12-25-19/h2-12,17,21H,13H2,1H3,(H,20,22,23)

Composition: C (64.57%), H (5.42%), N (11.89%), O (9.05%), S (9.07%)

Molar Mass: 353.44

Atom Count: 44

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 353.119798038
Formal Charge 0
FSP3 0.16
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey VOWCGMWRMOGBKJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 99.17
Topological Polar Surface Area 63.25
Polarizability 38.06
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 1031209-53-6 $51.35-$524.40$51.35$63.37$86.31$524.40
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