N-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}-3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Chemical Structure Depiction of
N-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}-3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
N-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}-3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-0509 |
| Compound Name: | N-{1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl}-3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide |
| Molecular Weight: | 471.31 |
| Molecular Formula: | C21 H19 Br N4 O4 |
| Smiles: | COc1ccccc1C1CC(C(Nc2cnn(COc3ccc(cc3)[Br])c2)=O)ON=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6977 |
| logD: | 3.69 |
| logSw: | -3.9018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.034 |
| InChI Key: | GIGACEKPJNRLTC-FQEVSTJZSA-N |