3-[4-(3-bromobenzoyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(3-bromobenzoyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
3-[4-(3-bromobenzoyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | T990-3487 |
| Compound Name: | 3-[4-(3-bromobenzoyl)piperazin-1-yl]-1-(3-methylbutyl)pyrrolidin-2-one |
| Molecular Weight: | 422.36 |
| Molecular Formula: | C20 H28 Br N3 O2 |
| Smiles: | CC(C)CCN1CCC(C1=O)N1CCN(CC1)C(c1cccc(c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9623 |
| logD: | 2.9601 |
| logSw: | -3.2074 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.488 |
| InChI Key: | ASJISBNLNKQTJQ-SFHVURJKSA-N |