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2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide

2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide

CAS: 1280298-31-8

Formula: C22H24N2O2S

SMILES: CC(C)CNC(=O)C(C)SC1=NC(=C(O1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]-N-(2-methylpropyl)propanamide

InChI: InChI=1/C22H24N2O2S/c1-15(2)14-23-21(25)16(3)27-22-24-19(17-10-6-4-7-11-17)20(26-22)18-12-8-5-9-13-18/h4-13,15-16H,14H2,1-3H3,(H,23,25)

Composition: C (69.44%), H (6.36%), N (7.36%), O (8.41%), S (8.43%)

Molar Mass: 380.51

Atom Count: 51

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 380.155849195
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VJJZPDDNFBJIGY-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 109.97
Topological Polar Surface Area 55.13
Polarizability 45.47
Ring Count 3
Rotatable Bond Count 7

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