ethyl 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0156 |
| Compound Name: | ethyl 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-oxopropyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 372.42 |
| Molecular Formula: | C20 H24 N2 O5 |
| Smiles: | CCOC(c1c(C)c(CCC(Nc2ccc3c(c2)OCCO3)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2369 |
| logD: | 2.2368 |
| logSw: | -2.8826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.674 |
| InChI Key: | XGZVKBUHQNHZBN-UHFFFAOYSA-N |