N-(4-acetamidophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
N-(4-acetamidophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0116 |
| Compound Name: | N-(4-acetamidophenyl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C21 H24 N6 O4 S |
| Smiles: | CC(Nc1ccc(cc1)NC(CCn1c2ccc(cc2nn1)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3127 |
| logD: | 1.3127 |
| logSw: | -2.4047 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.131 |
| InChI Key: | YMQHMNORAOTSPX-UHFFFAOYSA-N |