SMILES:
CC1(C)C(=O)NC(=O)N1CCNc1ncc(Br)c(-c2ccc(Cl)s2)n1Molecular Processing
Molecular formula
C15H15BrClN5O2S
Molecular weight
444.74
Exact mass
442.9818
XLogP
3.36
TPSA
87.22
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
100.87
Supplementary Information
Details werden geladen…
An 21 Reaktionen beteiligt→