4-({2-[3-(tert-butylamino)-3-oxopropyl]-2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinylidene}methyl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-({2-[3-(tert-butylamino)-3-oxopropyl]-2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinylidene}methyl)-2-methoxyphenyl acetate
4-({2-[3-(tert-butylamino)-3-oxopropyl]-2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinylidene}methyl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 4772-0499 |
| Compound Name: | 4-({2-[3-(tert-butylamino)-3-oxopropyl]-2-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinylidene}methyl)-2-methoxyphenyl acetate |
| Molecular Weight: | 500.57 |
| Molecular Formula: | C24 H28 N4 O6 S |
| Smiles: | CC(=O)Oc1ccc(/C=N/N(CCC(NC(C)(C)C)=O)C2c3ccccc3S(N=2)(=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.1207 |
| logD: | 2.1207 |
| logSw: | -3.1683 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.937 |
| InChI Key: | HZFWAUNFIJLXOD-UHFFFAOYSA-N |