N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-1H-pyrazole-3-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y504-9473 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C23 H22 N4 O6 |
| Smiles: | [H]N(C(c1ccn(CCC(Nc2ccc3c(c2)OCCO3)=O)n1)=O)c1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 0.5796 |
| logD: | 0.5794 |
| logSw: | -1.9265 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.492 |
| InChI Key: | GKOFZQULIAEXSK-UHFFFAOYSA-N |