N-[(2-chlorophenyl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
N-[(2-chlorophenyl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-3390 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide |
| Molecular Weight: | 468.93 |
| Molecular Formula: | C21 H22 Cl F N2 O5 S |
| Smiles: | C1CN(CCC12OCCO2)S(c1ccc(c(c1)C(NCc1ccccc1[Cl])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6106 |
| logD: | 3.6097 |
| logSw: | -4.0158 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.8 |
| InChI Key: | SNOCGHYRWIZWFS-UHFFFAOYSA-N |