3-(2-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
3-(2-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S564-0260 |
| Compound Name: | 3-(2-{4-[(5-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C19 H23 N5 O3 |
| Smiles: | CCc1nnc(CC2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.6522 |
| logD: | 1.6453 |
| logSw: | -2.2078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.225 |
| InChI Key: | GFSIOACWWCWXBA-UHFFFAOYSA-N |