4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | L532-1458 |
| Compound Name: | 4-({4-[5-(cyclopentylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile |
| Molecular Weight: | 497.67 |
| Molecular Formula: | C28 H31 N7 S |
| Smiles: | Cc1cccc(c1)c1c(NC2CCCC2)n2c(n1)sc(n2)N1CCN(CC1)Cc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4602 |
| logD: | 5.4028 |
| logSw: | -5.5205 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.373 |
| InChI Key: | KHVQEGHHYZZQOA-UHFFFAOYSA-N |