2-[2-(azepan-1-yl)-2-oxoethyl]-4-ethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
2-[2-(azepan-1-yl)-2-oxoethyl]-4-ethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-[2-(azepan-1-yl)-2-oxoethyl]-4-ethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C888-0186 |
| Compound Name: | 2-[2-(azepan-1-yl)-2-oxoethyl]-4-ethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C20 H24 N4 O2 |
| Smiles: | CCC1=NN(CC(N2CCCCCC2)=O)C(c2cc3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8074 |
| logD: | 2.8074 |
| logSw: | -3.1955 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.191 |
| InChI Key: | FKZXCVMRWBBAIB-UHFFFAOYSA-N |