SMILES:
CCn1nnnc1-c1cc(C(=O)NC(C)COC)cc(-c2ccc(C)cc2)c1Molecular Processing
Molecular formula
C21H25N5O2
Molecular weight
379.46
Exact mass
379.2008
XLogP
3.1
TPSA
81.93
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
107.9
Supplementary Information
상세 정보 불러오는 중…
6개 반응에 참여→