N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-N-(2-methoxyethyl)-5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-N-(2-methoxyethyl)-5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-N-(2-methoxyethyl)-5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | V004-0927 |
| Compound Name: | N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-N-(2-methoxyethyl)-5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C27 H31 N3 O6 |
| Smiles: | Cc1cc(C)c(c(C)c1)c1cc(C(N(CCC(NCc2ccc3c(c2)OCO3)=O)CCOC)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0545 |
| logD: | 4.0545 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.871 |
| InChI Key: | LRKXGJATSMHUIO-UHFFFAOYSA-N |