N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-fluorophenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-fluorophenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-fluorophenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G544-1316 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(3-fluorophenyl)-3-methyl-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 535.58 |
| Molecular Formula: | C31 H26 F N5 O3 |
| Smiles: | Cc1c2CN(C(c3cccc(c3)F)c3cccn3c2n(c2ccccc2)n1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1009 |
| logD: | 5.1009 |
| logSw: | -4.9536 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.819 |
| InChI Key: | YDSZPKKAWHUGOG-GDLZYMKVSA-N |