6-chloro-4-({3-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F543-0407 |
| Compound Name: | 6-chloro-4-({3-[2-oxo-1-(propan-2-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 439.86 |
| Molecular Formula: | C21 H18 Cl N5 O4 |
| Smiles: | CC(C)N1C(Nc2cc(ccc12)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3945 |
| logD: | 4.3945 |
| logSw: | -4.5912 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.227 |
| InChI Key: | IOXXFLYKESGCME-UHFFFAOYSA-N |