ethyl 1-phenyl-5-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-phenyl-5-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-1H-pyrazole-4-carboxylate
ethyl 1-phenyl-5-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8009-2812 |
| Compound Name: | ethyl 1-phenyl-5-{2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 515.59 |
| Molecular Formula: | C26 H25 N7 O3 S |
| Smiles: | CCCn1c2ccccc2c2c1nc(nn2)SCC(Nc1c(cnn1c1ccccc1)C(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9364 |
| logD: | 4.886 |
| logSw: | -4.5933 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.597 |
| InChI Key: | CGOHYVRSCIYDMD-UHFFFAOYSA-N |