3-({1-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}amino)-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-({1-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}amino)-2-hydroxypropyl butanoate
3-({1-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}amino)-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V005-5696 |
| Compound Name: | 3-({1-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}amino)-2-hydroxypropyl butanoate |
| Molecular Weight: | 440.34 |
| Molecular Formula: | C19 H26 Br N3 O4 |
| Smiles: | CCCC(=O)OCC(CNC(C(C)C)c1nc(c2ccc(cc2)[Br])no1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3692 |
| logD: | 4.3511 |
| logSw: | -4.1994 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.25 |
| InChI Key: | ZSVZIEADNQEUKD-UHFFFAOYSA-N |