N-[(2,4-dimethoxyphenyl)methyl]-1-(5-{2-[(4-methylanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2,4-dimethoxyphenyl)methyl]-1-(5-{2-[(4-methylanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
N-[(2,4-dimethoxyphenyl)methyl]-1-(5-{2-[(4-methylanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C794-1697 |
| Compound Name: | N-[(2,4-dimethoxyphenyl)methyl]-1-(5-{2-[(4-methylanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 546.69 |
| Molecular Formula: | C29 H34 N6 O3 S |
| Smiles: | Cc1ccc(cc1)NCc1cccn1c1nnc(N2CCC(CC2)C(NCc2ccc(cc2OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9914 |
| logD: | 4.9914 |
| logSw: | -4.6722 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.176 |
| InChI Key: | MSUVLAQIXBYPPO-UHFFFAOYSA-N |