N-[3-(azepan-1-yl)propyl]-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
N-[3-(azepan-1-yl)propyl]-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0541 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-3-[5-(dimethylsulfamoyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 436.58 |
| Molecular Formula: | C20 H32 N6 O3 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCC(NCCCN1CCCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0223 |
| logD: | -1.6063 |
| logSw: | -2.4075 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.933 |
| InChI Key: | WFGVFYNGUSMEOR-UHFFFAOYSA-N |