6-ethyl-4-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethyl-4-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-ethyl-4-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0696 |
| Compound Name: | 6-ethyl-4-{[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C24 H28 N2 O2 |
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(C(C)C1)c1cccc(C)c1)=CC(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6696 |
| logD: | 4.6261 |
| logSw: | -4.3832 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.857 |
| InChI Key: | IUQHMCGJVLPRKN-SFHVURJKSA-N |