CCCN(C)C(=O)C1=CC(=CC(=C1)C2=NC=CO2)C(=O)O
Nom: 3-[methyl(propyl)carbamoyl]-5-(1,3-oxazol-2-yl)benzoic acid
SMILES: CCCN(C)C(=O)C1=CC(=CC(=C1)C2=NC=CO2)C(=O)O

Molecular Processing

Molecular formula
C15H16N2O4
Molecular weight
288.3
Exact mass
288.111
XLogP
2.52
TPSA
83.64
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
76.15

Supplementary Information

InChIKey: CPZJRCIBYXFCPX-UHFFFAOYSA-N
Synonymes
SCHEMBL3348971CPZJRCIBYXFCPX-UHFFFAOYSA-NN-Methyl-5-oxazol-2-yl-N-propyl-isophthalamic acid3-{[Methyl(propyl)amino]carbonyl}-5-(1,3-oxazol-2-yl)benzoic Acid
Voir la source →
Impliqué dans 11 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→