SMILES:
O=c1[nH]c2ccccc2c(=O)n1CCCCSc1ccccn1Molecular Processing
Molecular formula
C17H17N3O2S
Molecular weight
327.41
Exact mass
327.1041
XLogP
2.66
TPSA
67.75
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
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
0.235
Molar refractivity
93.02
Supplementary Information
상세 정보 불러오는 중…
5개 반응에 참여→