C=CCNC(=O)NCC1Cc2ccc(-c3ccc(=O)[nH]n3)cc2C1
SMILES: C=CCNC(=O)NCC1Cc2ccc(-c3ccc(=O)[nH]n3)cc2C1

Molecular Processing

Molecular formula
C18H20N4O2
Molecular weight
324.38
Exact mass
324.1586
XLogP
1.64
TPSA
86.88
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
92.79

Supplementary Information

Details werden geladen…

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