N-{4-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]phenyl}-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{4-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]phenyl}-N'-(propan-2-yl)urea
N-{4-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]phenyl}-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | F532-0302 |
| Compound Name: | N-{4-[5-(2-oxo-2H-1-benzopyran-3-yl)-1,2,4-oxadiazol-3-yl]phenyl}-N'-(propan-2-yl)urea |
| Molecular Weight: | 390.4 |
| Molecular Formula: | C21 H18 N4 O4 |
| Smiles: | CC(C)NC(Nc1ccc(cc1)c1nc(C2=Cc3ccccc3OC2=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8224 |
| logD: | 3.8224 |
| logSw: | -4.32 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.437 |
| InChI Key: | SSDKBMYTRBZCCR-UHFFFAOYSA-N |