3-(3-chlorophenyl)-N-{3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl}prop-2-enamide
Chemical Structure Depiction of
3-(3-chlorophenyl)-N-{3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl}prop-2-enamide
3-(3-chlorophenyl)-N-{3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl}prop-2-enamide
Compound characteristics
| Compound ID: | K606-0063 |
| Compound Name: | 3-(3-chlorophenyl)-N-{3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]propyl}prop-2-enamide |
| Molecular Weight: | 403.89 |
| Molecular Formula: | C19 H18 Cl N3 O3 S |
| Smiles: | C(CNC1c2ccccc2S(N=1)(=O)=O)CNC(/C=C/c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7423 |
| logD: | 2.7423 |
| logSw: | -3.83 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.321 |
| InChI Key: | JVEKXOAKXWBCAG-MDZDMXLPSA-N |