N-(prop-2-en-1-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(prop-2-en-1-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
N-(prop-2-en-1-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D034-0127 |
| Compound Name: | N-(prop-2-en-1-yl)-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 280.3 |
| Molecular Formula: | C12 H12 N2 O4 S |
| Smiles: | C=CCNC(CN1C(c2ccccc2S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2028 |
| logD: | -0.2028 |
| logSw: | -2.4041 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.768 |
| InChI Key: | JMJDQGJTUTWBCI-UHFFFAOYSA-N |