4-{2-[2-amino-1-(2-methoxyethyl)-5-methyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]-1,3-thiazol-4-yl}benzonitrile
Chemical Structure Depiction of
4-{2-[2-amino-1-(2-methoxyethyl)-5-methyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]-1,3-thiazol-4-yl}benzonitrile
4-{2-[2-amino-1-(2-methoxyethyl)-5-methyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]-1,3-thiazol-4-yl}benzonitrile
Compound characteristics
| Compound ID: | V017-4103 |
| Compound Name: | 4-{2-[2-amino-1-(2-methoxyethyl)-5-methyl-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]-1,3-thiazol-4-yl}benzonitrile |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C18 H18 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC1C(C(=C(N)N1CCOC)c1nc(cs1)c1ccc(C#N)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.609 |
| logD: | 2.609 |
| logSw: | -2.9091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.421 |
| InChI Key: | WCGVVWSNLQXXCR-LLVKDONJSA-N |