3-ethyl-6-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
3-ethyl-6-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L799-1684 |
| Compound Name: | 3-ethyl-6-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C21 H30 N4 O5 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)CC(N1CCN(C)CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4552 |
| logD: | 1.2082 |
| logSw: | -2.5153 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.372 |
| InChI Key: | ASMCFBMZDRLZNN-UHFFFAOYSA-N |