methyl 2-{[1-(2H-1,3-benzodioxol-5-yl)-3-phenylpropan-2-yl]carbamamido}-4-methylbenzoate
Chemical Structure Depiction of
methyl 2-{[1-(2H-1,3-benzodioxol-5-yl)-3-phenylpropan-2-yl]carbamamido}-4-methylbenzoate
methyl 2-{[1-(2H-1,3-benzodioxol-5-yl)-3-phenylpropan-2-yl]carbamamido}-4-methylbenzoate
Compound characteristics
| Compound ID: | F107-1818 |
| Compound Name: | methyl 2-{[1-(2H-1,3-benzodioxol-5-yl)-3-phenylpropan-2-yl]carbamamido}-4-methylbenzoate |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C26 H26 N2 O5 |
| Smiles: | Cc1ccc(C(=O)OC)c(c1)NC(NC(Cc1ccccc1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0367 |
| logD: | 5.034 |
| logSw: | -4.7629 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.092 |
| InChI Key: | PSYAMXYHVQSFNH-FQEVSTJZSA-N |