N-(2,2-dimethoxyethyl)-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
N-(2,2-dimethoxyethyl)-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C794-1451 |
| Compound Name: | N-(2,2-dimethoxyethyl)-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 514.65 |
| Molecular Formula: | C25 H34 N6 O4 S |
| Smiles: | CCOc1ccc(cc1)NCc1cccn1c1nnc(N2CCC(CC2)C(NCC(OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0912 |
| logD: | 3.0912 |
| logSw: | -3.1622 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.892 |
| InChI Key: | LXSSUCVLBFGNIQ-UHFFFAOYSA-N |