N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]-2-phenoxybutanamide
Chemical Structure Depiction of
N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]-2-phenoxybutanamide
N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]-2-phenoxybutanamide
Compound characteristics
| Compound ID: | Y032-3355 |
| Compound Name: | N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]-2-phenoxybutanamide |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C19 H17 N3 O6 S2 |
| Smiles: | CCC(C(Nc1ncc(s1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3922 |
| logD: | 4.3788 |
| logSw: | -4.1327 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.452 |
| InChI Key: | MZZAJZKTNNOEKR-INIZCTEOSA-N |