5-[(3-methoxypropyl)amino]-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-[(3-methoxypropyl)amino]-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-[(3-methoxypropyl)amino]-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0895 |
| Compound Name: | 5-[(3-methoxypropyl)amino]-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C20 H26 N4 O4 S |
| Smiles: | CC1CCCN(C1)S(c1ccc(cc1)c1nc(C#N)c(NCCCOC)o1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6778 |
| logD: | 2.6778 |
| logSw: | -3.1708 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.378 |
| InChI Key: | KMPWKDAPFPRTCB-HNNXBMFYSA-N |