7-{2-hydroxy-3-[4-(pyridin-2-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one--hydrogen chloride (1/3)
Chemical Structure Depiction of
7-{2-hydroxy-3-[4-(pyridin-2-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one--hydrogen chloride (1/3)
7-{2-hydroxy-3-[4-(pyridin-2-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | D715-1667 |
| Compound Name: | 7-{2-hydroxy-3-[4-(pyridin-2-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one--hydrogen chloride (1/3) |
| Molecular Weight: | 504.84 |
| Molecular Formula: | C22 H25 N3 O4 |
| Salt: | 3HCl |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC(CN1CCN(CC1)c1ccccn1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5995 |
| logD: | 2.5411 |
| logSw: | -3.187 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.269 |
| InChI Key: | DAFGLDFFORJFSI-KRWDZBQOSA-N |