7-methyl-4-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-4-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
7-methyl-4-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0072 |
| Compound Name: | 7-methyl-4-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C25 H28 N2 O6 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)C(c3cc(c(c(c3)OC)OC)OC)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.3243 |
| logD: | 2.3231 |
| logSw: | -3.099 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.812 |
| InChI Key: | HEFSXZLAMQSBDH-UHFFFAOYSA-N |