N-(3-chloro-4-fluorophenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
N-(3-chloro-4-fluorophenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | K786-1325 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 508.95 |
| Molecular Formula: | C23 H22 Cl F N2 O6 S |
| Smiles: | Cc1c2cc(ccc2oc1C(Nc1ccc(c(c1)[Cl])F)=O)S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.492 |
| logD: | 4.11 |
| logSw: | -4.5036 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.003 |
| InChI Key: | ZBUWYIWBBCMWCZ-UHFFFAOYSA-N |