ethyl 4-(3-{[6-(methoxycarbonyl)-2H-1,3-benzodioxol-5-yl]amino}-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-{[6-(methoxycarbonyl)-2H-1,3-benzodioxol-5-yl]amino}-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-(3-{[6-(methoxycarbonyl)-2H-1,3-benzodioxol-5-yl]amino}-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0210 |
| Compound Name: | ethyl 4-(3-{[6-(methoxycarbonyl)-2H-1,3-benzodioxol-5-yl]amino}-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C21 H24 N2 O7 |
| Smiles: | CCOC(c1c(C)c(CCC(Nc2cc3c(cc2C(=O)OC)OCO3)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9769 |
| logD: | 2.459 |
| logSw: | -3.2097 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.443 |
| InChI Key: | LZUNHBQGYGRRLM-UHFFFAOYSA-N |