5-{[(2-chlorophenyl)methyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[(2-chlorophenyl)methyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0631 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 456.95 |
| Molecular Formula: | C22 H21 Cl N4 O3 S |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)c1nc(C#N)c(NCc2ccccc2[Cl])o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2313 |
| logD: | 4.2313 |
| logSw: | -4.419 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.989 |
| InChI Key: | LYISBEFZOWNJDV-UHFFFAOYSA-N |