ethyl 4-{4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-0544 |
| Compound Name: | ethyl 4-{4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C24 H31 N3 O7 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCC(CC1)C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9215 |
| logD: | 0.9214 |
| logSw: | -2.5069 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.396 |
| InChI Key: | SUHJHODQOSACNX-UHFFFAOYSA-N |