4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-sulfonyl}benzonitrile
4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | P435-1569 |
| Compound Name: | 4-{4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | Cc1c(C(N2CCCC2)=O)nc(C2CCN(CC2)S(c2ccc(C#N)cc2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4966 |
| logD: | 2.4966 |
| logSw: | -2.5665 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.647 |
| InChI Key: | MNDSEFMZFXLJKE-UHFFFAOYSA-N |