Name: N-ethyl-6-cyano-2,2-dimethyl-2H-1-benzopyran-4-carbamide
SMILES:
CCNC(=O)C1=CC(C)(C)Oc2ccc(C#N)cc21Molecular Processing
Molecular formula
C15H16N2O2
Molecular weight
256.31
Exact mass
256.1212
XLogP
2.25
TPSA
62.12
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
72.52
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→