2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G071-0745 |
| Compound Name: | 2-[(8-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 476.96 |
| Molecular Formula: | C20 H17 Cl N4 O4 S2 |
| Smiles: | CN1c2cc(ccc2c2c(cnc(n2)SCC(Nc2ccc(cc2)OC)=O)S1(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9127 |
| logD: | 3.9126 |
| logSw: | -4.3397 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.136 |
| InChI Key: | KDQWQFOXWKOFCF-UHFFFAOYSA-N |