4-[(4-cyclohexylpiperazin-1-yl)methyl]-5,7-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-[(4-cyclohexylpiperazin-1-yl)methyl]-5,7-dimethyl-2H-1-benzopyran-2-one
4-[(4-cyclohexylpiperazin-1-yl)methyl]-5,7-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0758 |
| Compound Name: | 4-[(4-cyclohexylpiperazin-1-yl)methyl]-5,7-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 354.49 |
| Molecular Formula: | C22 H30 N2 O2 |
| Smiles: | Cc1cc(C)c2C(CN3CCN(CC3)C3CCCCC3)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9473 |
| logD: | 2.7032 |
| logSw: | -4.0343 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.4717 |
| InChI Key: | XSUFLYSABLUBNS-UHFFFAOYSA-N |