N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)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-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-4547 |
| Compound Name: | N-(4-fluorophenyl)-2-({6-[(3-methoxyphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 536.6 |
| Molecular Formula: | C26 H21 F N4 O4 S2 |
| Smiles: | COc1cccc(CN2c3ccccc3c3c(cnc(n3)SCC(Nc3ccc(cc3)F)=O)S2(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4784 |
| logD: | 4.4783 |
| logSw: | -4.2989 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.86 |
| InChI Key: | BQZAPJXRQYVXHJ-UHFFFAOYSA-N |