N-[2-(3,4-diethoxyphenyl)ethyl]-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-(3,4-diethoxyphenyl)ethyl]-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C794-1468 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 618.8 |
| Molecular Formula: | C33 H42 N6 O4 S |
| Smiles: | CCOc1ccc(cc1)NCc1cccn1c1nnc(N2CCC(CC2)C(NCCc2ccc(c(c2)OCC)OCC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8992 |
| logD: | 4.8992 |
| logSw: | -4.4969 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.388 |
| InChI Key: | FOEKWCHCUBWVKF-UHFFFAOYSA-N |