C1C2=C(C=CC(=C2C(=O)N1)N)C3=CC=CS3
이름: 7-amino-4-thiophen-2-yl-2,3-dihydroisoindol-1-one
SMILES: C1C2=C(C=CC(=C2C(=O)N1)N)C3=CC=CS3

Molecular Processing

Molecular formula
C12H10N2OS
Molecular weight
230.29
Exact mass
230.0514
XLogP
2.24
TPSA
55.12
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
65.34

Supplementary Information

InChIKey: GXIWNXWVVULKKS-UHFFFAOYSA-N
동의어
SCHEMBL3047923GXIWNXWVVULKKS-UHFFFAOYSA-N7-amino-4-(thiophen-2-yl)isoindolinone
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