(5S)-N-benzyl-5-({4-[(dimethylamino)methyl]-5-methyl-1,2-oxazole-3-carbonyl}amino)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-N-benzyl-5-({4-[(dimethylamino)methyl]-5-methyl-1,2-oxazole-3-carbonyl}amino)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-N-benzyl-5-({4-[(dimethylamino)methyl]-5-methyl-1,2-oxazole-3-carbonyl}amino)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
| Compound ID: | SB70-0824 |
| Compound Name: | (5S)-N-benzyl-5-({4-[(dimethylamino)methyl]-5-methyl-1,2-oxazole-3-carbonyl}amino)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
| Molecular Weight: | 422.49 |
| Molecular Formula: | C22 H26 N6 O3 |
| Smiles: | Cc1c(CN(C)C)c(C(N[C@H]2Cc3cc(C(NCc4ccccc4)=O)nn3C2)=O)no1 |
| Stereo: | ABSOLUTE |
| logP: | 0.8873 |
| logD: | -3.6806 |
| logSw: | -2.0206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.746 |
| InChI Key: | QRSFIEWVSBWUSQ-INIZCTEOSA-N |