2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(3-methylphenyl)amino]ethyl 3-(3-chlorophenyl)prop-2-enoate
Chemical Structure Depiction of
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(3-methylphenyl)amino]ethyl 3-(3-chlorophenyl)prop-2-enoate
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(3-methylphenyl)amino]ethyl 3-(3-chlorophenyl)prop-2-enoate
Compound characteristics
| Compound ID: | K606-0179 |
| Compound Name: | 2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(3-methylphenyl)amino]ethyl 3-(3-chlorophenyl)prop-2-enoate |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C25 H21 Cl N2 O4 S |
| Smiles: | Cc1cccc(c1)N(CCOC(/C=C/c1cccc(c1)[Cl])=O)C1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8908 |
| logD: | 5.8908 |
| logSw: | -5.836 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.264 |
| InChI Key: | PJWHQIHPDQQLGI-UHFFFAOYSA-N |