(5S)-N-(2-methoxyethyl)-5-{[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino}-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-N-(2-methoxyethyl)-5-{[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino}-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-N-(2-methoxyethyl)-5-{[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino}-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
| Compound ID: | SB70-0945 |
| Compound Name: | (5S)-N-(2-methoxyethyl)-5-{[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]amino}-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C21 H24 N6 O4 |
| Smiles: | COCCNC(c1cc2C[C@@H](Cn2n1)NC(c1cc(c2cccc(c2)OC)n[nH]1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5199 |
| logD: | 1.5194 |
| logSw: | -2.0679 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.116 |
| InChI Key: | ITUHBRLQSKNZOG-CQSZACIVSA-N |