N-(3,5-dimethoxyphenyl)-2-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-2-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
N-(3,5-dimethoxyphenyl)-2-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | G071-0567 |
Compound Name: | N-(3,5-dimethoxyphenyl)-2-[(6-ethyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]acetamide |
Molecular Weight: | 486.57 |
Molecular Formula: | C22 H22 N4 O5 S2 |
Smiles: | CCN1c2ccccc2c2c(cnc(n2)SCC(Nc2cc(cc(c2)OC)OC)=O)S1(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3227 |
logD: | 3.3226 |
logSw: | -3.765 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.4 |
InChI Key: | UUPKIRCZQJLFSA-UHFFFAOYSA-N |