methyl 5-(azepan-1-yl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(azepan-1-yl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate
methyl 5-(azepan-1-yl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate
Compound characteristics
| Compound ID: | C066-5215 |
| Compound Name: | methyl 5-(azepan-1-yl)-3-(4-chlorophenyl)-1,2-oxazole-4-carboxylate |
| Molecular Weight: | 334.8 |
| Molecular Formula: | C17 H19 Cl N2 O3 |
| Smiles: | COC(c1c(c2ccc(cc2)[Cl])noc1N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2665 |
| logD: | 4.2665 |
| logSw: | -4.9039 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.041 |
| InChI Key: | CCQPEVHITDNAKO-UHFFFAOYSA-N |