methyl 6-[4-(2-chlorophenyl)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-(2-chlorophenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 6-[4-(2-chlorophenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | L811-0355 |
| Compound Name: | methyl 6-[4-(2-chlorophenyl)piperazin-1-yl]-4-cyclopropyl-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 491.97 |
| Molecular Formula: | C23 H23 Cl F N3 O4 S |
| Smiles: | COC(C1=CN(C2CC2)c2cc(c(cc2S1(=O)=O)F)N1CCN(CC1)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9271 |
| logD: | 3.9271 |
| logSw: | -4.2391 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.399 |
| InChI Key: | XKIBNVRLUDPCQS-UHFFFAOYSA-N |