N-(3,4-dimethoxyphenyl)-2-({6-[(3-methylphenyl)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-[(3-methylphenyl)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-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-5109 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-({6-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 562.67 |
| Molecular Formula: | C28 H26 N4 O5 S2 |
| Smiles: | Cc1cccc(CN2c3ccccc3c3c(cnc(n3)SCC(Nc3ccc(c(c3)OC)OC)=O)S2(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5755 |
| logD: | 4.5754 |
| logSw: | -4.3994 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.577 |
| InChI Key: | ITGOBEZCRDTSIR-UHFFFAOYSA-N |