N-tert-butyl-4-fluoro-N-{2-[1-(2-fluorophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-3-methylbenzamide
Chemical Structure Depiction of
N-tert-butyl-4-fluoro-N-{2-[1-(2-fluorophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-3-methylbenzamide
N-tert-butyl-4-fluoro-N-{2-[1-(2-fluorophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | V003-4588 |
| Compound Name: | N-tert-butyl-4-fluoro-N-{2-[1-(2-fluorophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-3-methylbenzamide |
| Molecular Weight: | 465.54 |
| Molecular Formula: | C27 H29 F2 N3 O2 |
| Smiles: | Cc1cc(ccc1F)C(N(CC(N1CCn2cccc2C1c1ccccc1F)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7995 |
| logD: | 4.7995 |
| logSw: | -4.5363 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.423 |
| InChI Key: | QYDNJAZGYVDPNW-RUZDIDTESA-N |