2-[4-(azepane-1-sulfonyl)phenyl]-5-(methylamino)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[4-(azepane-1-sulfonyl)phenyl]-5-(methylamino)-1,3-oxazole-4-carbonitrile
2-[4-(azepane-1-sulfonyl)phenyl]-5-(methylamino)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0767 |
| Compound Name: | 2-[4-(azepane-1-sulfonyl)phenyl]-5-(methylamino)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 360.43 |
| Molecular Formula: | C17 H20 N4 O3 S |
| Smiles: | CNc1c(C#N)nc(c2ccc(cc2)S(N2CCCCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4958 |
| logD: | 2.4958 |
| logSw: | -2.8435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.742 |
| InChI Key: | QJUIWAMRGAZFHP-UHFFFAOYSA-N |