1-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3,6,7-trimethylquinoxalin-2(1H)-one
Chemical Structure Depiction of
1-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3,6,7-trimethylquinoxalin-2(1H)-one
1-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3,6,7-trimethylquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | F670-0314 |
| Compound Name: | 1-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-3,6,7-trimethylquinoxalin-2(1H)-one |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | CC1C(N(CCC(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c2cc(C)c(C)cc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7626 |
| logD: | 2.4184 |
| logSw: | -2.9733 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.65 |
| InChI Key: | OMLMGZHRUBRZCS-UHFFFAOYSA-N |