1'-ethyl-3',5'-dimethyl-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
1'-ethyl-3',5'-dimethyl-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
1'-ethyl-3',5'-dimethyl-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | D754-0182 |
| Compound Name: | 1'-ethyl-3',5'-dimethyl-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 482.59 |
| Molecular Formula: | C28 H30 N6 O2 |
| Smiles: | CCn1c(C)c(c(C)n1)c1cc(C(NC[C@@H](CN2Cc3ccccc3C2=O)c2ccccc2)=O)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 3.4539 |
| logD: | 3.4538 |
| logSw: | -3.8523 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.066 |
| InChI Key: | DLJDPQGLVNWSDV-QFIPXVFZSA-N |