6-(4-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidine-1-carbonyl}piperidine-1-sulfonyl)-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-(4-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidine-1-carbonyl}piperidine-1-sulfonyl)-3-methyl-1,3-benzoxazol-2(3H)-one
6-(4-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidine-1-carbonyl}piperidine-1-sulfonyl)-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S544-1112 |
| Compound Name: | 6-(4-{3-[2-(2-fluorophenoxy)ethyl]pyrrolidine-1-carbonyl}piperidine-1-sulfonyl)-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 531.6 |
| Molecular Formula: | C26 H30 F N3 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)C(N1CCC(CCOc2ccccc2F)C1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3432 |
| logD: | 3.3432 |
| logSw: | -3.9408 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.996 |
| InChI Key: | HGVHCSYROCOCOD-SFHVURJKSA-N |