3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-6-(piperidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-6-(piperidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-6-(piperidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | C732-0114 |
Compound Name: | 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-6-(piperidine-1-sulfonyl)-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 435.54 |
Molecular Formula: | C21 H29 N3 O5 S |
Smiles: | CC1CC(C)CN(C1)C(CN1C(=O)Oc2cc(ccc12)S(N1CCCCC1)(=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.6739 |
logD: | 2.6739 |
logSw: | -3.2715 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 71.037 |
InChI Key: | OPJKJPGKMOOHTI-UHFFFAOYSA-N |