3-ethyl-N-[3-(methylsulfanyl)phenyl]-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
3-ethyl-N-[3-(methylsulfanyl)phenyl]-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
3-ethyl-N-[3-(methylsulfanyl)phenyl]-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G544-0789 |
| Compound Name: | 3-ethyl-N-[3-(methylsulfanyl)phenyl]-1,6-diphenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 519.67 |
| Molecular Formula: | C31 H29 N5 O S |
| Smiles: | CCc1c2CN(C(c3ccccc3)c3cccn3c2n(c2ccccc2)n1)C(Nc1cccc(c1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.102 |
| logD: | 7.102 |
| logSw: | -5.6841 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.684 |
| InChI Key: | QSKRNAJGZZJUFB-GDLZYMKVSA-N |