4-{4-[(6-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazine-1-carbonyl}-1-(4-methoxyphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-{4-[(6-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazine-1-carbonyl}-1-(4-methoxyphenyl)pyrrolidin-2-one
4-{4-[(6-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazine-1-carbonyl}-1-(4-methoxyphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | D222-0012 |
| Compound Name: | 4-{4-[(6-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazine-1-carbonyl}-1-(4-methoxyphenyl)pyrrolidin-2-one |
| Molecular Weight: | 491.54 |
| Molecular Formula: | C27 H29 N3 O6 |
| Smiles: | COc1ccc(cc1)N1CC(CC1=O)C(N1CCN(CC1)CC1=CC(=O)Oc2ccc(cc12)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7997 |
| logD: | 1.7974 |
| logSw: | -2.7334 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.672 |
| InChI Key: | PMVMNKODJHXZRC-IBGZPJMESA-N |