N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
Chemical Structure Depiction of
N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide
Compound characteristics
| Compound ID: | SC45-1023 |
| Compound Name: | N-[(5-benzyl-7-methyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrole-3-carboxamide |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C24 H30 N6 O3 |
| Smiles: | CC1C(N(Cc2ccccc2)Cc2c(CNC(c3cc(C)n(CCOC)c3C)=O)nnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.445 |
| logD: | 1.445 |
| logSw: | -2.4039 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.871 |
| InChI Key: | UJKZUFBVXMRTMP-SFHVURJKSA-N |