N-[4-chloro-2-(trifluoromethyl)phenyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-[4-chloro-2-(trifluoromethyl)phenyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
N-[4-chloro-2-(trifluoromethyl)phenyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-8499 |
| Compound Name: | N-[4-chloro-2-(trifluoromethyl)phenyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide |
| Molecular Weight: | 522.9 |
| Molecular Formula: | C21 H19 Cl F4 N2 O5 S |
| Smiles: | C1CN(CCC12OCCO2)S(c1ccc(c(c1)C(Nc1ccc(cc1C(F)(F)F)[Cl])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3678 |
| logD: | 4.1463 |
| logSw: | -4.5873 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.78 |
| InChI Key: | NAMIRFQMMWXYCI-UHFFFAOYSA-N |