2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]ethyl 4-chlorobenzoate
Chemical Structure Depiction of
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]ethyl 4-chlorobenzoate
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]ethyl 4-chlorobenzoate
Compound characteristics
| Compound ID: | 8006-4893 |
| Compound Name: | 2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]ethyl 4-chlorobenzoate |
| Molecular Weight: | 378.83 |
| Molecular Formula: | C17 H15 Cl N2 O4 S |
| Smiles: | CN(CCOC(c1ccc(cc1)[Cl])=O)C1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.343 |
| logD: | 3.343 |
| logSw: | -3.9315 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.659 |
| InChI Key: | ULFCCZBESRXBIN-UHFFFAOYSA-N |