4-[2-(2-amino-1-cyclohexyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl)-1,3-thiazol-4-yl]benzonitrile
Chemical Structure Depiction of
4-[2-(2-amino-1-cyclohexyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl)-1,3-thiazol-4-yl]benzonitrile
4-[2-(2-amino-1-cyclohexyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl)-1,3-thiazol-4-yl]benzonitrile
Compound characteristics
| Compound ID: | V025-3014 |
| Compound Name: | 4-[2-(2-amino-1-cyclohexyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl)-1,3-thiazol-4-yl]benzonitrile |
| Molecular Weight: | 364.47 |
| Molecular Formula: | C20 H20 N4 O S |
| Smiles: | C1CCC(CC1)N1CC(C(=C1N)c1nc(cs1)c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1123 |
| logD: | 4.1123 |
| logSw: | -4.3291 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.322 |
| InChI Key: | XHMAOUDWEHKQAT-UHFFFAOYSA-N |