N,N-diethyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N,N-diethyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
N,N-diethyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8003-3813 |
| Compound Name: | N,N-diethyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 315.39 |
| Molecular Formula: | C15 H17 N5 O S |
| Smiles: | CCN(CC)C(CSc1nc2c(c3ccccc3[nH]2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8428 |
| logD: | 1.8428 |
| logSw: | -2.3839 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.211 |
| InChI Key: | CGKOKKIBBRMBPU-UHFFFAOYSA-N |