SMILES:
CC1(C)CC(Nc2nccc(-c3ccc(Br)s3)n2)CC(C)(C)N1Molecular Processing
Molecular formula
C17H23BrN4S
Molecular weight
395.37
Exact mass
394.0827
XLogP
4.69
TPSA
49.84
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
100.98
Supplementary Information
Загрузка подробностей…
Участвует в 14 реакциях→