6-ethyl-4-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethyl-4-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-ethyl-4-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0701 |
| Compound Name: | 6-ethyl-4-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(CC1)c1ccccn1)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.4576 |
| logD: | 3.4114 |
| logSw: | -3.7045 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.15 |
| InChI Key: | OAUXOLFBALGKAQ-UHFFFAOYSA-N |