이름: 2-(4-aminophenyl)-9-chloro-4,4a,5,6-tetrahydrobenzo[h]cinnolin-3(2H)-one
SMILES:
Nc1ccc(N2N=C3c4cc(Cl)ccc4CCC3CC2=O)cc1Molecular Processing
Molecular formula
C18H16ClN3O
Molecular weight
325.8
Exact mass
325.0982
XLogP
3.63
TPSA
58.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
92.76
Supplementary Information
상세 정보 불러오는 중…
6개 반응에 참여→