COc1ccc(C(N)=C(C)C(N)=S)cc1
이름: 3-amino-3-(4-methoxyphenyl)-2-methyl-thioacrylamide
SMILES: COc1ccc(C(N)=C(C)C(N)=S)cc1

Molecular Processing

Molecular formula
C11H14N2OS
Molecular weight
222.31
Exact mass
222.0827
XLogP
1.67
TPSA
61.27
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
66.56

Supplementary Information

상세 정보 불러오는 중…

3개 반응에 참여