이름: title compound
SMILES:
CCOC(=O)Cc1ccc(-n2nc(C(C)(C)C)cc2N)cc1.ClMolecular Processing
Molecular formula
C17H24ClN3O2
Molecular weight
337.85
Exact mass
337.1557
XLogP
3.28
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.412
Molar refractivity
94.26
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→