4-({4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]piperazin-1-yl}methyl)-6-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-({4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]piperazin-1-yl}methyl)-6-ethoxy-2H-1-benzopyran-2-one
4-({4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]piperazin-1-yl}methyl)-6-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0533 |
| Compound Name: | 4-({4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]piperazin-1-yl}methyl)-6-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)CC(N1CCc3ccccc13)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.3673 |
| logD: | 2.3604 |
| logSw: | -3.0753 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.465 |
| InChI Key: | RIOFFQYFQSEETA-UHFFFAOYSA-N |