ethyl 2-{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 6623-1364 |
| Compound Name: | ethyl 2-{2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C22 H24 N6 O3 S2 |
| Smiles: | CCC(C(Nc1nc(C)c(C(=O)OCC)s1)=O)Sc1nc2c(c3ccccc3n2CC)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9588 |
| logD: | 4.8492 |
| logSw: | -4.6878 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.443 |
| InChI Key: | UECDJZMHMZWVMG-HNNXBMFYSA-N |