({1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}amino)(oxo)acetic acid
Chemical Structure Depiction of
({1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}amino)(oxo)acetic acid
({1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}amino)(oxo)acetic acid
Compound characteristics
| Compound ID: | Y500-3928 |
| Compound Name: | ({1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}amino)(oxo)acetic acid |
| Molecular Weight: | 352.18 |
| Molecular Formula: | C14 H14 Br N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)[Br])n1)NC(C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1078 |
| logD: | -1.9478 |
| logSw: | -2.118 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.896 |
| InChI Key: | XGINGLLXNOAPQP-UHFFFAOYSA-N |