COC(=O)c1cc(C)c2[nH]c(C(Cl)(Cl)Cl)nc2c1.COC(=O)c1cc(C)c2[nH]c(C(Cl)(Cl)Cl)nc2c1
SMILES: COC(=O)c1cc(C)c2[nH]c(C(Cl)(Cl)Cl)nc2c1.COC(=O)c1cc(C)c2[nH]c(C(Cl)(Cl)Cl)nc2c1

Molecular Processing

Molecular formula
C22H18Cl6N4O4
Molecular weight
615.13
Exact mass
611.9459
XLogP
6.97
TPSA
109.96
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
2
Fraction Csp3
0.273
Molar refractivity
142.81

Supplementary Information

상세 정보 불러오는 중…

1개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→