4-tert-butyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
4-tert-butyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | Y032-0580 |
| Compound Name: | 4-tert-butyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C18 H17 N3 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5774 |
| logD: | 5.5744 |
| logSw: | -5.4127 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.473 |
| InChI Key: | CFYGOZKZPFLAGT-UHFFFAOYSA-N |