N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-8870 |
| Compound Name: | N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 367.24 |
| Molecular Formula: | C15 H19 Br N4 O2 |
| Smiles: | Cc1c(cn(CCCNC(c2c3CCCCc3on2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.7048 |
| logD: | 1.7048 |
| logSw: | -1.9722 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.002 |
| InChI Key: | ULOUIIYEMKCSAO-UHFFFAOYSA-N |