4-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]butanamide
Chemical Structure Depiction of
4-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]butanamide
4-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]butanamide
Compound characteristics
| Compound ID: | F848-0238 |
| Compound Name: | 4-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]-N-[3-(pyrrolidin-1-yl)propyl]butanamide |
| Molecular Weight: | 462.61 |
| Molecular Formula: | C22 H34 N6 O3 S |
| Smiles: | C1CCN(CC1)S(c1ccc2c(c1)nnn2CCCC(NCCCN1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7016 |
| logD: | -2.3889 |
| logSw: | -2.3958 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.015 |
| InChI Key: | ANUSXSWGEAPEGK-UHFFFAOYSA-N |