6-chloro-4-({3-[4-(pyrrolidine-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-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F819-0115 |
| Compound Name: | 6-chloro-4-({3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 474.92 |
| Molecular Formula: | C21 H19 Cl N4 O5 S |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4255 |
| logD: | 3.4255 |
| logSw: | -3.9277 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.488 |
| InChI Key: | MAWRDQWBWMTHPX-UHFFFAOYSA-N |