diethyl ({[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino}methylidene)propanedioate
Chemical Structure Depiction of
diethyl ({[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino}methylidene)propanedioate
diethyl ({[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino}methylidene)propanedioate
Compound characteristics
| Compound ID: | 8010-4548 |
| Compound Name: | diethyl ({[3-(3-bromophenyl)-1H-pyrazol-5-yl]amino}methylidene)propanedioate |
| Molecular Weight: | 408.25 |
| Molecular Formula: | C17 H18 Br N3 O4 |
| Smiles: | CCOC(C(=CNc1cc(c2cccc(c2)[Br])n[nH]1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8258 |
| logD: | 3.6228 |
| logSw: | -3.9427 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.404 |
| InChI Key: | ZJSASPKNTLVVFH-UHFFFAOYSA-N |