3-(1-ethylpyrrolidin-3-yl)-7-(2-phenylethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Chemical Structure Depiction of
3-(1-ethylpyrrolidin-3-yl)-7-(2-phenylethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
3-(1-ethylpyrrolidin-3-yl)-7-(2-phenylethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Compound characteristics
| Compound ID: | S841-0183 |
| Compound Name: | 3-(1-ethylpyrrolidin-3-yl)-7-(2-phenylethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine |
| Molecular Weight: | 339.48 |
| Molecular Formula: | C20 H29 N5 |
| Smiles: | CCN1CCC(C1)c1nnc2CCN(CCc3ccccc3)CCn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8571 |
| logD: | -1.453 |
| logSw: | -1.6442 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.81 |
| InChI Key: | YDWXWHQMJRQKMF-SFHVURJKSA-N |