4-{[7-(4-ethylpiperazin-1-yl)-5,8-difluoro-1,1-dioxo-2,3-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-4(1H)-yl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-{[7-(4-ethylpiperazin-1-yl)-5,8-difluoro-1,1-dioxo-2,3-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-4(1H)-yl]methyl}benzene-1-sulfonamide
4-{[7-(4-ethylpiperazin-1-yl)-5,8-difluoro-1,1-dioxo-2,3-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-4(1H)-yl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8610-0690 |
| Compound Name: | 4-{[7-(4-ethylpiperazin-1-yl)-5,8-difluoro-1,1-dioxo-2,3-dihydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-4(1H)-yl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 501.57 |
| Molecular Formula: | C20 H25 F2 N5 O4 S2 |
| Smiles: | CCN1CCN(CC1)c1c(c2c(c(n1)F)N(CCS2(=O)=O)Cc1ccc(cc1)S(N)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 1.1168 |
| logD: | 0.7103 |
| logSw: | -2.1271 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.277 |
| InChI Key: | FOQPICAURPXQBT-UHFFFAOYSA-N |