4-ethyl-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-ethyl-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
4-ethyl-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D635-0145 |
| Compound Name: | 4-ethyl-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | CCC1=CC(=O)Oc2c1ccc(c2CN1CCN(C)CC1)O |
| Stereo: | ACHIRAL |
| logP: | 1.7995 |
| logD: | 1.0006 |
| logSw: | -2.8083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.087 |
| InChI Key: | MORAZUGDTJBJOE-UHFFFAOYSA-N |