N-{1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}-5-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
N-{1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}-5-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}-1,3,4-thiadiazol-2-amine
N-{1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}-5-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | Y503-1852 |
| Compound Name: | N-{1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}-5-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 465.96 |
| Molecular Formula: | C22 H20 Cl N7 O S |
| Smiles: | Cc1cc(C)n(Cc2ccc(c3nnc(Nc4ccn(Cc5ccccc5[Cl])n4)s3)o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4692 |
| logD: | 4.4692 |
| logSw: | -4.4709 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.957 |
| InChI Key: | COQBTRLIIFYRLF-UHFFFAOYSA-N |