CCOC(=O)CC(c1cc(OC)ncn1)C1CC1
Name: ethyl 3-cyclopropyl-3-(6-methoxypyrimidin-4-yl)propanoate
SMILES: CCOC(=O)CC(c1cc(OC)ncn1)C1CC1

Molecular Processing

Molecular formula
C13H18N2O3
Molecular weight
250.3
Exact mass
250.1317
XLogP
1.93
TPSA
61.31
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
65.3

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt