5-(azepan-1-yl)-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0907 |
| Compound Name: | 5-(azepan-1-yl)-2-[4-(3-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C22 H28 N4 O3 S |
| Smiles: | CC1CCCN(C1)S(c1ccc(cc1)c1nc(C#N)c(N2CCCCCC2)o1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2419 |
| logD: | 4.2419 |
| logSw: | -4.1054 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.73 |
| InChI Key: | JWAPYYZYMSNBFZ-KRWDZBQOSA-N |