COc1c(N(C(C)=O)C(C)=O)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2n(CC(C)C)c1=O
SMILES: COc1c(N(C(C)=O)C(C)=O)c2cc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)nc2n(CC(C)C)c1=O

Molecular Processing

Molecular formula
C29H26Cl3N3O4
Molecular weight
586.9
Exact mass
585.0989
XLogP
7.25
TPSA
81.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
39
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
157.14

Supplementary Information

상세 정보 불러오는 중…

1개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→