N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]isoquinoline-1-carboxamide
N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | M466-1191 |
| Compound Name: | N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]isoquinoline-1-carboxamide |
| Molecular Weight: | 321.36 |
| Molecular Formula: | C17 H11 N3 O2 S |
| Smiles: | c1ccc2c(c1)ccnc2C(Nc1cc(c2ccsc2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5309 |
| logD: | 3.5309 |
| logSw: | -3.7263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.176 |
| InChI Key: | BEKXMIVAEPOLEU-UHFFFAOYSA-N |