2-(3,5-dimethoxyanilino)-2-oxoethyl {1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetate
Chemical Structure Depiction of
2-(3,5-dimethoxyanilino)-2-oxoethyl {1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetate
2-(3,5-dimethoxyanilino)-2-oxoethyl {1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetate
Compound characteristics
| Compound ID: | K261-1183 |
| Compound Name: | 2-(3,5-dimethoxyanilino)-2-oxoethyl {1-[(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)methyl]cyclopentyl}acetate |
| Molecular Weight: | 515.58 |
| Molecular Formula: | C25 H29 N3 O7 S |
| Smiles: | COc1cc(cc(c1)OC)NC(COC(CC1(CCCC1)CC1NS(c2ccccc2N=1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8545 |
| logD: | 2.2801 |
| logSw: | -3.5857 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.682 |
| InChI Key: | CLSVXLRXVJDDHK-UHFFFAOYSA-N |