N-benzyl-N-methyl-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
Chemical Structure Depiction of
N-benzyl-N-methyl-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
N-benzyl-N-methyl-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
Compound characteristics
| Compound ID: | F848-0018 |
| Compound Name: | N-benzyl-N-methyl-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C22 H27 N5 O3 S |
| Smiles: | CN(Cc1ccccc1)C(CCCn1c2ccc(cc2nn1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3497 |
| logD: | 2.3497 |
| logSw: | -2.834 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.614 |
| InChI Key: | MNTAQUNVIRQQAC-UHFFFAOYSA-N |