N-[1-{1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl}-2-oxo-2-(pyrrolidin-1-yl)ethyl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[1-{1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl}-2-oxo-2-(pyrrolidin-1-yl)ethyl]-3-methoxybenzamide
N-[1-{1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl}-2-oxo-2-(pyrrolidin-1-yl)ethyl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V028-4263 |
| Compound Name: | N-[1-{1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl}-2-oxo-2-(pyrrolidin-1-yl)ethyl]-3-methoxybenzamide |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C26 H31 F N4 O3 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(NC(C1CCN(CC1)C(Nc1ccc(cc1)F)=S)C(N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0761 |
| logD: | 4.076 |
| logSw: | -4.2885 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.46 |
| InChI Key: | UATUZJNCWSLJOZ-QHCPKHFHSA-N |