7-methyl-5-(2-oxo-2-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethoxy)-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-5-(2-oxo-2-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethoxy)-4-propyl-2H-1-benzopyran-2-one
7-methyl-5-(2-oxo-2-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethoxy)-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | IB07-2034 |
| Compound Name: | 7-methyl-5-(2-oxo-2-{4-[(pyridin-4-yl)methyl]piperazin-1-yl}ethoxy)-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | CCCC1=CC(=O)Oc2cc(C)cc(c12)OCC(N1CCN(CC1)Cc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.35 |
| logD: | 2.33 |
| logSw: | -3.12 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 121.39 |
| InChI Key: | HRMHGXPFCFRBNH-UHFFFAOYSA-N |