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3-phenyl-5-[(phenylsulfanyl)methyl]-1,2-oxazole

3-phenyl-5-[(phenylsulfanyl)methyl]-1,2-oxazole

CAS: 478048-74-7

Formula: C16H13NOS

SMILES: C(SC1=CC=CC=C1)C1=CC(=NO1)C1=CC=CC=C1

IUPAC: 3-phenyl-5-[(phenylsulfanyl)methyl]-1,2-oxazole

InChI: InChI=1S/C16H13NOS/c1-3-7-13(8-4-1)16-11-14(18-17-16)12-19-15-9-5-2-6-10-15/h1-11H,12H2

Composition: C (71.88%), H (4.90%), N (5.24%), O (5.98%), S (11.99%)

Molar Mass: 267.35

Atom Count: 32

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 267.071785217
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey ALOSNTJZINUQLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.72
Topological Polar Surface Area 26.03
Polarizability 31.81
Ring Count 3
Rotatable Bond Count 4

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