SMILES:
Cc1ccc2c(c1)CC(N1CCNCC1)c1ccccc1S2Molecular Processing
Molecular formula
C19H22N2S
Molecular weight
310.47
Exact mass
310.1504
XLogP
3.65
TPSA
15.27
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
92.63
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→