N-(4-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-N'-propylurea
Chemical Structure Depiction of
N-(4-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-N'-propylurea
N-(4-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-N'-propylurea
Compound characteristics
| Compound ID: | F532-0260 |
| Compound Name: | N-(4-{5-[(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-N'-propylurea |
| Molecular Weight: | 441.87 |
| Molecular Formula: | C21 H20 Cl N5 O4 |
| Smiles: | CCCNC(Nc1ccc(cc1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8245 |
| logD: | 3.8245 |
| logSw: | -4.4431 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.149 |
| InChI Key: | BNCQUBHMEZEHLP-UHFFFAOYSA-N |