3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
Chemical Structure Depiction of
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate
Compound characteristics
| Compound ID: | K606-0021 |
| Compound Name: | 3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3-(3-chlorophenyl)prop-2-enoate |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C22 H15 Cl N2 O4 S |
| Smiles: | C(=C/c1cccc(c1)[Cl])\C(=O)Oc1cccc(c1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5988 |
| logD: | 4.5191 |
| logSw: | -4.7353 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.627 |
| InChI Key: | AHQLXZFKGNCGKI-UHFFFAOYSA-N |