2-(2-methoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
Chemical Structure Depiction of
2-(2-methoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
2-(2-methoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
Compound characteristics
| Compound ID: | K261-1408 |
| Compound Name: | 2-(2-methoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | CC(C)(CC1NS(c2ccccc2N=1)(=O)=O)CC(=O)OCC(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0575 |
| logD: | 1.4832 |
| logSw: | -2.7319 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.24 |
| InChI Key: | VXZUBUXMRXVQEC-UHFFFAOYSA-N |