5-{[4-(3-chlorobenzamido)phenoxy]methyl}-N-[3-(morpholin-4-yl)propyl]-1,2-oxazole-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-{[4-(3-chlorobenzamido)phenoxy]methyl}-N-[3-(morpholin-4-yl)propyl]-1,2-oxazole-3-carboxamide--trifluoroacetic acid (1/1)
5-{[4-(3-chlorobenzamido)phenoxy]methyl}-N-[3-(morpholin-4-yl)propyl]-1,2-oxazole-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L422-0829 |
| Compound Name: | 5-{[4-(3-chlorobenzamido)phenoxy]methyl}-N-[3-(morpholin-4-yl)propyl]-1,2-oxazole-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 612.99 |
| Molecular Formula: | C25 H27 Cl N4 O5 |
| Salt: | CF3COOH |
| Smiles: | C(CNC(c1cc(COc2ccc(cc2)NC(c2cccc(c2)[Cl])=O)on1)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.1479 |
| logD: | 2.7596 |
| logSw: | -3.7178 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.68 |
| InChI Key: | HZBWMHRCIYTJDY-UHFFFAOYSA-N |