4-nitro-5-(propan-2-yl)-N-[(thiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
4-nitro-5-(propan-2-yl)-N-[(thiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
4-nitro-5-(propan-2-yl)-N-[(thiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0918 |
| Compound Name: | 4-nitro-5-(propan-2-yl)-N-[(thiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 295.31 |
| Molecular Formula: | C12 H13 N3 O4 S |
| Smiles: | CC(C)c1c(c(C(NCc2cccs2)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6391 |
| logD: | 2.639 |
| logSw: | -2.9065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.26 |
| InChI Key: | WAUJNVLYTSAOPE-UHFFFAOYSA-N |