2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(3-methoxypropyl)acetamide
2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(3-methoxypropyl)acetamide
Compound characteristics
| Compound ID: | G071-0722 |
| Compound Name: | 2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(3-methoxypropyl)acetamide |
| Molecular Weight: | 442.94 |
| Molecular Formula: | C17 H19 Cl N4 O4 S2 |
| Smiles: | CN1c2ccc(cc2c2c(cnc(n2)SCC(NCCCOC)=O)S1(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1962 |
| logD: | 2.1962 |
| logSw: | -3.3424 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.37 |
| InChI Key: | PYVUXRFNAOTFCX-UHFFFAOYSA-N |