N-(3,4-dimethoxyphenyl)-2-[(6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-[(6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
N-(3,4-dimethoxyphenyl)-2-[(6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G071-0464 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-[(6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C21 H20 N4 O5 S2 |
| Smiles: | CN1c2ccccc2c2c(cnc(n2)SCC(Nc2ccc(c(c2)OC)OC)=O)S1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7493 |
| logD: | 2.7492 |
| logSw: | -3.5545 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.854 |
| InChI Key: | YGPIULQBLNFCGB-UHFFFAOYSA-N |