이름: [2-(4-phenylbutyl)-6,7-dihydro-8H-indeno[5,4-d][1,3]oxazol-8-ylidene]acetonitrile
SMILES:
N#CC=C1CCc2ccc3nc(CCCCc4ccccc4)oc3c21Molecular Processing
Molecular formula
C22H20N2O
Molecular weight
328.42
Exact mass
328.1576
XLogP
5.25
TPSA
49.82
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
99
Supplementary Information
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