N-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
N-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D257-0677 |
| Compound Name: | N-{4-[(prop-2-en-1-yl)oxy]phenyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C18 H16 N2 O5 S |
| Smiles: | C=CCOc1ccc(cc1)NC(CN1C(c2ccccc2S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.018 |
| logD: | 2.018 |
| logSw: | -2.9726 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.751 |
| InChI Key: | WHCJHQQZDUMTPX-UHFFFAOYSA-N |