이름: (E)-3-{4-[1-(2-cyano-ethyl)-pyrrolidin-2-yl]-phenyl}-acrylic acid methyl ester
SMILES:
COC(=O)/C=C/c1ccc(C2CCCN2CCC#N)cc1Molecular Processing
Molecular formula
C17H20N2O2
Molecular weight
284.36
Exact mass
284.1525
XLogP
2.92
TPSA
53.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
81.27
Supplementary Information
상세 정보 불러오는 중…
4개 반응에 참여→