N-benzyl-5-(2,5-dimethoxyphenyl)-N-(3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-benzyl-5-(2,5-dimethoxyphenyl)-N-(3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl)-1,2-oxazole-3-carboxamide
N-benzyl-5-(2,5-dimethoxyphenyl)-N-(3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V001-9432 |
| Compound Name: | N-benzyl-5-(2,5-dimethoxyphenyl)-N-(3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 500.55 |
| Molecular Formula: | C28 H28 N4 O5 |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)c1cc(C(N(CCC(NCc2cccnc2)=O)Cc2ccccc2)=O)no1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.962 |
| logD: | 2.9595 |
| logSw: | -3.2257 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.855 |
| InChI Key: | HEFNKLUPPRRHHQ-UHFFFAOYSA-N |