5-{[3-(dimethylamino)propyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[3-(dimethylamino)propyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[3-(dimethylamino)propyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0648 |
| Compound Name: | 5-{[3-(dimethylamino)propyl]amino}-2-[4-(piperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C20 H27 N5 O3 S |
| Smiles: | CN(C)CCCNc1c(C#N)nc(c2ccc(cc2)S(N2CCCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.0224 |
| logD: | 0.0152 |
| logSw: | -2.6721 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.967 |
| InChI Key: | IOEHUDAXMBWYLS-UHFFFAOYSA-N |