N-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl}benzenesulfonamide
Chemical Structure Depiction of
N-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl}benzenesulfonamide
N-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl}benzenesulfonamide
Compound characteristics
| Compound ID: | 8011-2017 |
| Compound Name: | N-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethyl}benzenesulfonamide |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C20 H21 N5 O2 S2 |
| Smiles: | CCCn1c2ccccc2c2c1nc(nn2)SCCNS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8564 |
| logD: | 3.8563 |
| logSw: | -3.9242 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.828 |
| InChI Key: | AHFTZRITPYJYML-UHFFFAOYSA-N |