6-chloro-4-({3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F819-0264 |
| Compound Name: | 6-chloro-4-({3-[4-(piperidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 488.95 |
| Molecular Formula: | C22 H21 Cl N4 O5 S |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.756 |
| logD: | 3.756 |
| logSw: | -4.2327 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.122 |
| InChI Key: | AEAYWMFZKTYMRU-UHFFFAOYSA-N |