(5S)-5-{[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino}-N-(2-methoxyethyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-5-{[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino}-N-(2-methoxyethyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-5-{[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino}-N-(2-methoxyethyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
| Compound ID: | SB70-0980 |
| Compound Name: | (5S)-5-{[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino}-N-(2-methoxyethyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
| Molecular Weight: | 428.88 |
| Molecular Formula: | C20 H21 Cl N6 O3 |
| Smiles: | COCCNC(c1cc2C[C@@H](Cn2n1)NC(c1cc(c2ccccc2[Cl])n[nH]1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8216 |
| logD: | 1.8211 |
| logSw: | -2.9977 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.573 |
| InChI Key: | YJFYPBNPDUQLKV-LBPRGKRZSA-N |