Cl.Cn1ccc2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCOCC3)c21
SMILES: Cl.Cn1ccc2c(Nc3cccc(Cl)c3)ncc(C(=O)N3CCOCC3)c21

Molecular Processing

Molecular formula
C19H20Cl2N4O2
Molecular weight
407.3
Exact mass
406.0963
XLogP
3.86
TPSA
59.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.263
Molar refractivity
109.42

Supplementary Information

상세 정보 불러오는 중…

1개 반응에 참여