N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | E751-3720 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1-(4-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C24 H22 N4 O3 |
| Smiles: | Cc1ccc(cc1)n1c(c(C(Nc2ccc3c(c2)OCCO3)=O)c(C)n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6655 |
| logD: | 3.6654 |
| logSw: | -4.0258 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.362 |
| InChI Key: | XDVHBKRFPAQFTB-UHFFFAOYSA-N |