5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropane-1-sulfonyl)-1-methyl-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropane-1-sulfonyl)-1-methyl-1,3-dihydro-2H-indol-2-one
5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropane-1-sulfonyl)-1-methyl-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | G069-0822 |
| Compound Name: | 5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropane-1-sulfonyl)-1-methyl-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C24 H27 N3 O6 S |
| Smiles: | CN1C(Cc2cc(ccc12)S(CCC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7835 |
| logD: | 0.4392 |
| logSw: | -2.3465 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.835 |
| InChI Key: | CDFPSOHTQSRSHT-UHFFFAOYSA-N |