N-(2-methoxy-5-methylphenyl)-2-({6-[(2-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-methoxy-5-methylphenyl)-2-({6-[(2-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
N-(2-methoxy-5-methylphenyl)-2-({6-[(2-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: | G071-0422 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-2-({6-[(2-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 546.67 |
| Molecular Formula: | C28 H26 N4 O4 S2 |
| Smiles: | Cc1ccc(c(c1)NC(CSc1ncc2c(c3ccccc3N(Cc3ccccc3C)S2(=O)=O)n1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.9872 |
| logD: | 4.9872 |
| logSw: | -4.476 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.248 |
| InChI Key: | KGGDAJZPJJLELN-UHFFFAOYSA-N |