9-(benzyloxy)-4-[(4-phenylpiperazin-1-yl)acetyl]-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
9-(benzyloxy)-4-[(4-phenylpiperazin-1-yl)acetyl]-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one--hydrogen chloride (1/1)
9-(benzyloxy)-4-[(4-phenylpiperazin-1-yl)acetyl]-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5682-0165 |
| Compound Name: | 9-(benzyloxy)-4-[(4-phenylpiperazin-1-yl)acetyl]-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one--hydrogen chloride (1/1) |
| Molecular Weight: | 546.07 |
| Molecular Formula: | C31 H31 N3 O4 |
| Salt: | HCl |
| Smiles: | C1CC2=C(C(=O)Oc3ccc(cc23)OCc2ccccc2)N(C1)C(CN1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3625 |
| logD: | 4.3608 |
| logSw: | -4.4635 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.672 |
| InChI Key: | JSRFPTSOIDFJMN-UHFFFAOYSA-N |