Nombre: trans-[4-(2-Hydroxy-ethylsulfanylmethyl)-cyclohexyl]-methyl-carbamic acid 4-chloro-phenyl ester
SMILES:
CN(C(=O)Oc1ccc(Cl)cc1)[C@H]1CC[C@H](CSCCO)CC1Molecular Processing
Molecular formula
C17H24ClNO3S
Molecular weight
357.9
Exact mass
357.1165
XLogP
4.05
TPSA
49.77
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
95.4
Supplementary Information
No supplementary data available
Participa en 2 reacciones→