N-(3-chloro-4-methoxyphenyl)-2-({6-[(4-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-chloro-4-methoxyphenyl)-2-({6-[(4-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
N-(3-chloro-4-methoxyphenyl)-2-({6-[(4-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: | C200-5334 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-({6-[(4-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 567.08 |
| Molecular Formula: | C27 H23 Cl N4 O4 S2 |
| Smiles: | Cc1ccc(CN2c3ccccc3c3c(cnc(n3)SCC(Nc3ccc(c(c3)[Cl])OC)=O)S2(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.328 |
| logD: | 5.3277 |
| logSw: | -5.7379 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.946 |
| InChI Key: | BOCWGBSKDUPPHA-UHFFFAOYSA-N |