3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)propanamide
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)propanamide
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)propanamide
Compound characteristics
| Compound ID: | S638-4495 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)propanamide |
| Molecular Weight: | 318.38 |
| Molecular Formula: | C15 H22 N6 O2 |
| Smiles: | Cc1cc(C)n(CCC(NC2CCC3=NNC(N3CC2)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0123 |
| logD: | -0.0188 |
| logSw: | -1.2602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.836 |
| InChI Key: | AXVKUDKLBXTZEC-GFCCVEGCSA-N |