N-cyclohexyl-2-{4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methylacetamide
Chemical Structure Depiction of
N-cyclohexyl-2-{4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methylacetamide
N-cyclohexyl-2-{4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methylacetamide
Compound characteristics
| Compound ID: | J079-0787 |
| Compound Name: | N-cyclohexyl-2-{4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methylacetamide |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C25 H35 N3 O3 |
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(CC1)CC(N(C)C1CCCCC1)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.8262 |
| logD: | 2.6631 |
| logSw: | -3.192 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.865 |
| InChI Key: | NYGIHRWSUVZDDE-UHFFFAOYSA-N |