4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | F510-0088 |
| Compound Name: | 4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C27 H31 N3 O3 S |
| Smiles: | C1CCN(C1)C(c1ccc2c(c1)N(CC(N1CCC(CC1)Cc1ccccc1)=O)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3185 |
| logD: | 3.3185 |
| logSw: | -3.7009 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.754 |
| InChI Key: | KGCQRZUQOTXCIM-UHFFFAOYSA-N |