N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-5-(2,4-dichlorophenyl)-N-[(oxolan-2-yl)methyl]-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-5-(2,4-dichlorophenyl)-N-[(oxolan-2-yl)methyl]-1,2-oxazole-3-carboxamide
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-5-(2,4-dichlorophenyl)-N-[(oxolan-2-yl)methyl]-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V003-3040 |
| Compound Name: | N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-5-(2,4-dichlorophenyl)-N-[(oxolan-2-yl)methyl]-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 546.41 |
| Molecular Formula: | C26 H25 Cl2 N3 O6 |
| Smiles: | C1CC(CN(CCC(NCc2ccc3c(c2)OCO3)=O)C(c2cc(c3ccc(cc3[Cl])[Cl])on2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1102 |
| logD: | 4.1102 |
| logSw: | -4.5786 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.933 |
| InChI Key: | OXRIOPRZVNPNNW-GOSISDBHSA-N |