4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-6-methoxy-2H-1-benzopyran-2-one
4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0225 |
| Compound Name: | 4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.43 |
| Molecular Formula: | C22 H23 F N2 O3 |
| Smiles: | COc1ccc2c(c1)C(CN1CCN(CC1)Cc1ccc(cc1)F)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.667 |
| logD: | 2.4827 |
| logSw: | -3.1382 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.463 |
| InChI Key: | BFKZQWOYQFSDDO-UHFFFAOYSA-N |