(5S)-5-{[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]amino}-N-(propan-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-5-{[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]amino}-N-(propan-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-5-{[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]amino}-N-(propan-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
| Compound ID: | SB70-0696 |
| Compound Name: | (5S)-5-{[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]amino}-N-(propan-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C20 H29 N5 O3 |
| Smiles: | CC(C)NC(c1cc2C[C@@H](Cn2n1)NC(c1cc(C)n(CCOC)c1C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1681 |
| logD: | 1.1681 |
| logSw: | -2.0143 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.387 |
| InChI Key: | HEMPQYLJAHQOKB-OAHLLOKOSA-N |