N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-3-nitrobenzamide
N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2783-3318 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-3-nitrobenzamide |
| Molecular Weight: | 391.4 |
| Molecular Formula: | C20 H13 N3 O4 S |
| Smiles: | c1ccc2c(c1)nc(c1ccc(cc1O)NC(c1cccc(c1)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.0987 |
| logD: | 5.0914 |
| logSw: | -4.8911 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.708 |
| InChI Key: | JEAHEAIQPROIEB-UHFFFAOYSA-N |