5-(butylamino)-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(butylamino)-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-(butylamino)-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0820 |
| Compound Name: | 5-(butylamino)-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | CCCCNc1c(C#N)nc(c2ccc(cc2)S(N2CCC(C)CC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9668 |
| logD: | 3.9668 |
| logSw: | -3.919 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.102 |
| InChI Key: | BQCDNAYMHGJHBC-UHFFFAOYSA-N |