6-chloro-7-methyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-methyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
6-chloro-7-methyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3819 |
| Compound Name: | 6-chloro-7-methyl-4-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 306.79 |
| Molecular Formula: | C16 H19 Cl N2 O2 |
| Smiles: | Cc1cc2c(cc1[Cl])C(CN1CCN(C)CC1)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.7295 |
| logD: | 1.5891 |
| logSw: | -3.5414 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.8549 |
| InChI Key: | UOYMMMBMKPLQQD-UHFFFAOYSA-N |