4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L310-2898 |
| Compound Name: | 4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 490.53 |
| Molecular Formula: | C22 H26 N4 O7 S |
| Smiles: | Cc1cc2c(cc1S(N1CCC3(CC1)OCCO3)(=O)=O)OCC(N2Cc1nc(C2CC2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0659 |
| logD: | 2.0659 |
| logSw: | -2.3258 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 103.407 |
| InChI Key: | ZDZQYXHKGNKRFU-UHFFFAOYSA-N |