2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(5-fluoro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(5-fluoro-2-methylphenyl)acetamide
2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(5-fluoro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | G071-0690 |
| Compound Name: | 2-[(9-chloro-6-methyl-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]-N-(5-fluoro-2-methylphenyl)acetamide |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C20 H16 Cl F N4 O3 S2 |
| Smiles: | Cc1ccc(cc1NC(CSc1ncc2c(c3cc(ccc3N(C)S2(=O)=O)[Cl])n1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.9037 |
| logD: | 3.9035 |
| logSw: | -4.2464 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.895 |
| InChI Key: | LMXFOVWODKXVBR-UHFFFAOYSA-N |