6-{4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
6-{4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L799-0955 |
| Compound Name: | 6-{4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C21 H30 N4 O5 S |
| Smiles: | CCN1CCN(CC1)C(CC1CCN(CC1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2986 |
| logD: | 0.9781 |
| logSw: | -2.4564 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.473 |
| InChI Key: | OQOCDBPTBAKUFA-UHFFFAOYSA-N |