ethyl 4-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0544 |
| Compound Name: | ethyl 4-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C21 H25 N3 O7 S |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCCC1C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6609 |
| logD: | 0.66 |
| logSw: | -2.4045 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.764 |
| InChI Key: | JQJPJDDREJPHSI-INIZCTEOSA-N |