7-methoxy-4,8-dimethyl-3-(3-oxo-3-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methoxy-4,8-dimethyl-3-(3-oxo-3-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propyl)-2H-1-benzopyran-2-one
7-methoxy-4,8-dimethyl-3-(3-oxo-3-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-7447 |
| Compound Name: | 7-methoxy-4,8-dimethyl-3-(3-oxo-3-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}propyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | CC1=C(CCC(N2CCN(CCc3ccccn3)CC2)=O)C(=O)Oc2c1ccc(c2C)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8197 |
| logD: | 2.7764 |
| logSw: | -3.2236 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.658 |
| InChI Key: | PSVRFURHTZLXJM-UHFFFAOYSA-N |