4-chloro-2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
Chemical Structure Depiction of
4-chloro-2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
4-chloro-2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
Compound characteristics
| Compound ID: | K606-0049 |
| Compound Name: | 4-chloro-2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate |
| Molecular Weight: | 473.33 |
| Molecular Formula: | C22 H14 Cl2 N2 O4 S |
| Smiles: | C(=C/c1cccc(c1)[Cl])\C(=O)Oc1ccc(cc1NC1c2ccccc2S(N=1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0341 |
| logD: | 2.8152 |
| logSw: | -5.1069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.016 |
| InChI Key: | NGOIZPRZTXAZPO-UHFFFAOYSA-N |