(3S,7S,8aS)-7-acetamido-N-(3-methylbutyl)-3-(2-methylpropyl)-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Chemical Structure Depiction of
(3S,7S,8aS)-7-acetamido-N-(3-methylbutyl)-3-(2-methylpropyl)-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
(3S,7S,8aS)-7-acetamido-N-(3-methylbutyl)-3-(2-methylpropyl)-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide
Compound characteristics
| Compound ID: | S974-4896 |
| Compound Name: | (3S,7S,8aS)-7-acetamido-N-(3-methylbutyl)-3-(2-methylpropyl)-4-oxohexahydropyrrolo[1,2-a]pyrazine-2(1H)-carboxamide |
| Molecular Weight: | 366.5 |
| Molecular Formula: | C19 H34 N4 O3 |
| Smiles: | CC(C)CCNC(N1C[C@@H]2C[C@@H](CN2C([C@@H]1CC(C)C)=O)NC(C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1132 |
| logD: | 2.1132 |
| logSw: | -2.3217 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.374 |
| InChI Key: | KVEYTQBDKGMLHI-IKGGRYGDSA-N |