N-(1,3-benzothiazol-2-yl)-4-methoxy-N-(4-methoxy-3-nitrobenzoyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-4-methoxy-N-(4-methoxy-3-nitrobenzoyl)-3-nitrobenzamide
N-(1,3-benzothiazol-2-yl)-4-methoxy-N-(4-methoxy-3-nitrobenzoyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9266 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-4-methoxy-N-(4-methoxy-3-nitrobenzoyl)-3-nitrobenzamide |
| Molecular Weight: | 508.46 |
| Molecular Formula: | C23 H16 N4 O8 S |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(N(C(c1ccc(c(c1)[N+]([O-])=O)OC)=O)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4485 |
| logD: | 3.4485 |
| logSw: | -3.9794 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 119.262 |
| InChI Key: | QWIGVVFHQGDLLU-UHFFFAOYSA-N |