{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{1-[(oxan-2-yl)methyl]-4-[(prop-2-en-1-yl)oxy]-1H-indol-2-yl}methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{1-[(oxan-2-yl)methyl]-4-[(prop-2-en-1-yl)oxy]-1H-indol-2-yl}methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{1-[(oxan-2-yl)methyl]-4-[(prop-2-en-1-yl)oxy]-1H-indol-2-yl}methanone
Compound characteristics
| Compound ID: | V008-8388 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}{1-[(oxan-2-yl)methyl]-4-[(prop-2-en-1-yl)oxy]-1H-indol-2-yl}methanone |
| Molecular Weight: | 517.63 |
| Molecular Formula: | C30 H35 N3 O5 |
| Salt: | not_available |
| Smiles: | C=CCOc1cccc2c1cc(C(N1CCN(CC1)Cc1ccc3c(c1)OCO3)=O)n2CC1CCCCO1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6431 |
| logD: | 4.451 |
| logSw: | -4.6393 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.789 |
| InChI Key: | NHRAYPMHYFJEMD-HSZRJFAPSA-N |