N,N-diethyl-2-[(8-methoxy-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-amine
Chemical Structure Depiction of
N,N-diethyl-2-[(8-methoxy-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-amine
N,N-diethyl-2-[(8-methoxy-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-amine
Compound characteristics
| Compound ID: | IB03-6364 |
| Compound Name: | N,N-diethyl-2-[(8-methoxy-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-amine |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C17 H23 N5 O S |
| Smiles: | CCN(CC)CCSc1nc2c(c3cc(ccc3n2C)OC)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.77 |
| logD: | 1.6 |
| logSw: | -2.85 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 104.68 |
| InChI Key: | XRUNFWJNBFPVGJ-UHFFFAOYSA-N |