N-[(3S,7S,8aS)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Chemical Structure Depiction of
N-[(3S,7S,8aS)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
N-[(3S,7S,8aS)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
Compound characteristics
| Compound ID: | S974-4898 |
| Compound Name: | N-[(3S,7S,8aS)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3-(2-methylpropyl)-4-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C18 H28 N4 O5 S |
| Smiles: | CC(C)C[C@H]1C(N2C[C@H](C[C@H]2CN1S(c1c(C)noc1C)(=O)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.4066 |
| logD: | 0.4066 |
| logSw: | -1.847 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.996 |
| InChI Key: | FJVIYKSTMXEIGR-OAGGEKHMSA-N |