N-[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]-4-methyl-3-nitrobenzamide
N-[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2783-3254 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C21 H15 N3 O4 S |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(c(c1)c1nc2ccccc2s1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8295 |
| logD: | 5.8288 |
| logSw: | -5.2664 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.407 |
| InChI Key: | DLMBYGNJQLLKOB-UHFFFAOYSA-N |