3-[2-(azepan-1-yl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
3-[2-(azepan-1-yl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | G305-0063 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 274.32 |
| Molecular Formula: | C15 H18 N2 O3 |
| Smiles: | C1CCCN(CC1)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0287 |
| logD: | 2.0287 |
| logSw: | -2.3391 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.791 |
| InChI Key: | CZBCJPWKEFNOSI-UHFFFAOYSA-N |