2-benzyl-8-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
Chemical Structure Depiction of
2-benzyl-8-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
2-benzyl-8-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one
Compound characteristics
| Compound ID: | SD18-0360 |
| Compound Name: | 2-benzyl-8-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2,5,6,8-tetrahydro-3H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-one |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C22 H22 N4 O3 |
| Smiles: | C1CN(C(CC2C3=NN(Cc4ccccc4)C(N3CCO2)=O)=O)c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7539 |
| logD: | 2.7538 |
| logSw: | -2.8843 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.069 |
| InChI Key: | HMSVHXAYUSDJEN-IBGZPJMESA-N |