SMILES:
Cl.O=C(Nc1cn(C2CCNCC2)nc1-c1cc(Cl)ccc1OC(F)F)c1cnn2cccnc12Molecular Processing
Molecular formula
C22H21Cl2F2N7O2
Molecular weight
524.36
Exact mass
523.1102
XLogP
4.45
TPSA
98.37
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
2
Fraction Csp3
0.273
Molar refractivity
128.63
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→