N-tert-butyl-5-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-2-(thiophen-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Chemical Structure Depiction of
N-tert-butyl-5-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-2-(thiophen-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
N-tert-butyl-5-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-2-(thiophen-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide
Compound characteristics
| Compound ID: | E223-1300 |
| Compound Name: | N-tert-butyl-5-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-2-(thiophen-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-6-carboxamide |
| Molecular Weight: | 456.99 |
| Molecular Formula: | C23 H25 Cl N4 O2 S |
| Smiles: | Cc1ccc(c(c1)[Cl])N1C(c2cc(c3cccs3)nn2CC1(C)C(NC(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.791 |
| logD: | 4.791 |
| logSw: | -4.8854 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.675 |
| InChI Key: | SMLBKCAGMGZZHT-QHCPKHFHSA-N |