5-{[2-(dimethylamino)ethyl]amino}-2-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[2-(dimethylamino)ethyl]amino}-2-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[2-(dimethylamino)ethyl]amino}-2-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0747 |
| Compound Name: | 5-{[2-(dimethylamino)ethyl]amino}-2-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C18 H23 N5 O3 S |
| Smiles: | CN(C)CCNc1c(C#N)nc(c2ccc(cc2)S(N2CCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.6855 |
| logD: | 0.1878 |
| logSw: | -2.6008 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.333 |
| InChI Key: | QZULPRCVQKBEGC-UHFFFAOYSA-N |