N-{(3S,7S,8aS)-3-(2-methylpropyl)-2-[(3-methylthiophen-2-yl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Chemical Structure Depiction of
N-{(3S,7S,8aS)-3-(2-methylpropyl)-2-[(3-methylthiophen-2-yl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
N-{(3S,7S,8aS)-3-(2-methylpropyl)-2-[(3-methylthiophen-2-yl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide
Compound characteristics
| Compound ID: | S974-1483 |
| Compound Name: | N-{(3S,7S,8aS)-3-(2-methylpropyl)-2-[(3-methylthiophen-2-yl)methyl]-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}acetamide |
| Molecular Weight: | 363.52 |
| Molecular Formula: | C19 H29 N3 O2 S |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1Cc1c(C)ccs1)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.2615 |
| logD: | 2.2189 |
| logSw: | -2.6381 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.386 |
| InChI Key: | LGOQJDLXAAIKPM-ZACQAIPSSA-N |