N-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)-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: | G071-0322 |
| Compound Name: | N-(2,5-dimethylphenyl)-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: | 530.67 |
| Molecular Formula: | C28 H26 N4 O3 S2 |
| Smiles: | Cc1cccc(CN2c3ccccc3c3c(cnc(n3)SCC(Nc3cc(C)ccc3C)=O)S2(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0817 |
| logD: | 5.0817 |
| logSw: | -4.717 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.618 |
| InChI Key: | AJFXZDRDDKABFI-UHFFFAOYSA-N |