3-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-5-methoxy-4,7-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-5-methoxy-4,7-dimethyl-2H-1-benzopyran-2-one
3-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-5-methoxy-4,7-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | IB09-0277 |
| Compound Name: | 3-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}-5-methoxy-4,7-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 496.61 |
| Molecular Formula: | C31 H32 N2 O4 |
| Smiles: | CC1=C(CC(N2CCN(CC2)C(c2ccccc2)c2ccccc2)=O)C(=O)Oc2cc(C)cc(c12)OC |
| Stereo: | ACHIRAL |
| logP: | 5.33 |
| logD: | 5.33 |
| logSw: | -6.04 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 77.21 |
| InChI Key: | FYKASIPUJNMHNE-UHFFFAOYSA-N |