5-{[(2-chlorophenyl)methyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[(2-chlorophenyl)methyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0681 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]amino}-2-[4-(morpholine-4-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 458.92 |
| Molecular Formula: | C21 H19 Cl N4 O4 S |
| Smiles: | C(c1ccccc1[Cl])Nc1c(C#N)nc(c2ccc(cc2)S(N2CCOCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2418 |
| logD: | 3.2418 |
| logSw: | -3.8061 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.897 |
| InChI Key: | CIEDNLACPIIRAK-UHFFFAOYSA-N |