6-ethyl-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethyl-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
6-ethyl-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0829 |
| Compound Name: | 6-ethyl-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C23 H25 F N2 O2 |
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(CC1)Cc1ccc(cc1)F)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.5001 |
| logD: | 3.3159 |
| logSw: | -3.7288 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.9187 |
| InChI Key: | GVCVHXPPOZESLF-UHFFFAOYSA-N |