1-(4-benzylpiperidin-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
Chemical Structure Depiction of
1-(4-benzylpiperidin-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
1-(4-benzylpiperidin-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
Compound characteristics
| Compound ID: | F514-0087 |
| Compound Name: | 1-(4-benzylpiperidin-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C25 H31 N5 O3 S |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nnn2CCC(N1CCC(CC1)Cc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2286 |
| logD: | 3.2286 |
| logSw: | -3.6005 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.841 |
| InChI Key: | CCCNBXDAFNVDRO-UHFFFAOYSA-N |