N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | Y040-8898 |
| Compound Name: | N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C24 H29 N3 O5 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CCCNC(C1COc2ccccc2O1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2486 |
| logD: | 2.2483 |
| logSw: | -2.6389 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.127 |
| InChI Key: | JQIXWQJMLVBQFP-QFIPXVFZSA-N |