5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0690 |
| Compound Name: | 5-{[3-(1H-imidazol-1-yl)propyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 442.5 |
| Molecular Formula: | C20 H22 N6 O4 S |
| Smiles: | C(CNc1c(C#N)nc(c2ccc(cc2)S(N2CCOCC2)(=O)=O)o1)Cn1ccnc1 |
| Stereo: | ACHIRAL |
| logP: | 0.9384 |
| logD: | 0.6965 |
| logSw: | -2.1839 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.539 |
| InChI Key: | WHAISRQECXDZNC-UHFFFAOYSA-N |