5-[(4-tert-butylphenyl)methoxy]-2-{[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(4-tert-butylphenyl)methoxy]-2-{[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(4-tert-butylphenyl)methoxy]-2-{[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V007-1640 |
| Compound Name: | 5-[(4-tert-butylphenyl)methoxy]-2-{[4-(2-methoxy-4-methylbenzene-1-sulfonyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C29 H36 N2 O6 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)OC)S(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)C(C)(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7776 |
| logD: | 4.7775 |
| logSw: | -4.6141 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.032 |
| InChI Key: | JZKMZRXCVAJZHT-UHFFFAOYSA-N |