methyl 6-[4-(4-acetylphenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 6-[4-(4-acetylphenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 6-[4-(4-acetylphenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | L811-0359 |
| Compound Name: | methyl 6-[4-(4-acetylphenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 499.56 |
| Molecular Formula: | C25 H26 F N3 O5 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)c1cc2c(cc1F)S(C(=CN2C1CC1)C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9161 |
| logD: | 2.9161 |
| logSw: | -3.4701 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.527 |
| InChI Key: | BPBDSUKRXAGSNE-UHFFFAOYSA-N |