2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4-dimethoxybenzoate
2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4-dimethoxybenzoate
Compound characteristics
Compound ID: | K606-0160 |
Compound Name: | 2-[(2-chlorophenyl)(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4-dimethoxybenzoate |
Molecular Weight: | 500.96 |
Molecular Formula: | C24 H21 Cl N2 O6 S |
Smiles: | COc1ccc(cc1OC)C(=O)OCCN(C1c2ccccc2S(N=1)(=O)=O)c1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 4.313 |
logD: | 4.313 |
logSw: | -4.4542 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 77.819 |
InChI Key: | BDHIPSFTYNUZFL-UHFFFAOYSA-N |