N-[(3-bromophenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-[(3-bromophenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-1977 |
| Compound Name: | N-[(3-bromophenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 474.42 |
| Molecular Formula: | C21 H24 Br N5 O S |
| Smiles: | Cc1ccc(C)n1c1nnc(N2CCC(CC2)C(NCc2cccc(c2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8019 |
| logD: | 3.8019 |
| logSw: | -3.7522 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.127 |
| InChI Key: | LBLAZMDCCXWIJC-UHFFFAOYSA-N |