N-(4-fluorophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
N-(4-fluorophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0040 |
| Compound Name: | N-(4-fluorophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C19 H20 F N5 O3 S |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nnn2CCC(Nc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1406 |
| logD: | 2.1402 |
| logSw: | -3.0014 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.869 |
| InChI Key: | AYEFKRPKWKZIQL-UHFFFAOYSA-N |