CC(C)(C)OC(=O)N1CCC(CNc2cc(Cl)ncn2)CC1
SMILES: CC(C)(C)OC(=O)N1CCC(CNc2cc(Cl)ncn2)CC1

Molecular Processing

Molecular formula
C15H23ClN4O2
Molecular weight
326.83
Exact mass
326.151
XLogP
3.19
TPSA
67.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
86.06

Supplementary Information

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