CC(C)C1=CC2=C(C=C1)N(C(=O)C=C2)CC3OCCO3
이름: 1-(1,3-dioxolan-2-ylmethyl)-6-propan-2-ylquinolin-2-one
SMILES: CC(C)C1=CC2=C(C=C1)N(C(=O)C=C2)CC3OCCO3

Molecular Processing

Molecular formula
C16H19NO3
Molecular weight
273.33
Exact mass
273.1365
XLogP
2.5
TPSA
40.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
77.99

Supplementary Information

InChIKey: BHYVSMJVLGBVFB-UHFFFAOYSA-N
동의어
SCHEMBL2796661BHYVSMJVLGBVFB-UHFFFAOYSA-N1-(1,3-dioxolan-2-ylmethyl)-6-isopropylquinolin-2(1h)-one
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