N-(5-chloro-2-hydroxyphenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-hydroxyphenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-(5-chloro-2-hydroxyphenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | C582-0870 |
Compound Name: | N-(5-chloro-2-hydroxyphenyl)-4-nitro-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 325.71 |
Molecular Formula: | C13 H12 Cl N3 O5 |
Smiles: | CC(C)c1c(c(C(Nc2cc(ccc2O)[Cl])=O)no1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.3276 |
logD: | 2.7216 |
logSw: | -3.5773 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.77 |
InChI Key: | WRQYOTHUHVIQBO-UHFFFAOYSA-N |