SMILES:
COC(=O)c1cc(Cc2ccc(-n3cccn3)cc2)c(C#N)c(C)c1OMolecular Processing
Molecular formula
C20H17N3O3
Molecular weight
347.37
Exact mass
347.127
XLogP
3.14
TPSA
88.14
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
95.27
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→