N-[(4-chlorophenyl)methyl]-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-[(4-chlorophenyl)methyl]-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0920 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 323.73 |
| Molecular Formula: | C14 H14 Cl N3 O4 |
| Smiles: | CC(C)c1c(c(C(NCc2ccc(cc2)[Cl])=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2588 |
| logD: | 3.257 |
| logSw: | -3.7528 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.242 |
| InChI Key: | ATMYZOBHTPLOOD-UHFFFAOYSA-N |