7-(4-benzylpiperidine-1-sulfonyl)-2,4-diethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Chemical Structure Depiction of
7-(4-benzylpiperidine-1-sulfonyl)-2,4-diethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
7-(4-benzylpiperidine-1-sulfonyl)-2,4-diethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one
Compound characteristics
| Compound ID: | P666-2569 |
| Compound Name: | 7-(4-benzylpiperidine-1-sulfonyl)-2,4-diethylpyrrolo[1,2-d][1,2,4]triazin-1(2H)-one |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C22 H28 N4 O3 S |
| Smiles: | CCC1=NN(CC)C(c2cc(cn12)S(N1CCC(CC1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6284 |
| logD: | 3.6272 |
| logSw: | -3.7365 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.719 |
| InChI Key: | QHBICEBFRIZKHL-UHFFFAOYSA-N |