4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 3,4-dimethoxybenzoate
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | 4137-0334 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]phenyl 3,4-dimethoxybenzoate |
| Molecular Weight: | 452.48 |
| Molecular Formula: | C23 H20 N2 O6 S |
| Smiles: | CN(C1c2ccccc2S(N=1)(=O)=O)c1ccc(cc1)OC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7221 |
| logD: | 2.7221 |
| logSw: | -3.5634 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.49 |
| InChI Key: | WKZDWELEJJFAPC-UHFFFAOYSA-N |