N-[(3-chloro-4-fluorophenyl)methyl]-4-{[3-(thiomorpholin-4-yl)pyrazin-2-yl]oxy}benzamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-4-{[3-(thiomorpholin-4-yl)pyrazin-2-yl]oxy}benzamide
N-[(3-chloro-4-fluorophenyl)methyl]-4-{[3-(thiomorpholin-4-yl)pyrazin-2-yl]oxy}benzamide
Compound characteristics
| Compound ID: | M006-0539 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-4-{[3-(thiomorpholin-4-yl)pyrazin-2-yl]oxy}benzamide |
| Molecular Weight: | 458.94 |
| Molecular Formula: | C22 H20 Cl F N4 O2 S |
| Smiles: | C(c1ccc(c(c1)[Cl])F)NC(c1ccc(cc1)Oc1c(nccn1)N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3488 |
| logD: | 4.3488 |
| logSw: | -4.6123 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.638 |
| InChI Key: | YHILRINPTLNQKV-UHFFFAOYSA-N |