N-{2-[1-(4-methylphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-4-nitro-N-propylbenzamide
Chemical Structure Depiction of
N-{2-[1-(4-methylphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-4-nitro-N-propylbenzamide
N-{2-[1-(4-methylphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-4-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V006-9961 |
| Compound Name: | N-{2-[1-(4-methylphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}-4-nitro-N-propylbenzamide |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C26 H28 N4 O4 |
| Smiles: | CCCN(CC(N1CCn2cccc2C1c1ccc(C)cc1)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2863 |
| logD: | 4.2863 |
| logSw: | -4.1262 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.676 |
| InChI Key: | MVKLMNMRKPMOJE-RUZDIDTESA-N |