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N-(5-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-yl)acetamide

N-(5-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-yl)acetamide

CAS: 315705-75-0

Formula: C16H16N4O2S2

SMILES: COC1=CC=CC=C1NC1=NC(=CS1)C1=C(C)N=C(NC(C)=O)S1

IUPAC: N-(5-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}-4-methyl-1,3-thiazol-2-yl)acetamide

InChI: InChI=1S/C16H16N4O2S2/c1-9-14(24-16(17-9)18-10(2)21)12-8-23-15(20-12)19-11-6-4-5-7-13(11)22-3/h4-8H,1-3H3,(H,19,20)(H,17,18,21)

Composition: C (53.32%), H (4.47%), N (15.54%), O (8.88%), S (17.79%)

Molar Mass: 360.45

Atom Count: 40

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 360.071468119
Formal Charge 0
FSP3 0.19
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey ZADCDCMLLGDCRM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.37
Topological Polar Surface Area 76.14
Polarizability 36.77
Ring Count 3
Rotatable Bond Count 5

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