[3-(7-ethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)pyrrolidin-1-yl](phenyl)methanone
Chemical Structure Depiction of
[3-(7-ethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)pyrrolidin-1-yl](phenyl)methanone
[3-(7-ethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)pyrrolidin-1-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S841-0010 |
| Compound Name: | [3-(7-ethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)pyrrolidin-1-yl](phenyl)methanone |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C19 H25 N5 O |
| Smiles: | CCN1CCc2nnc(C3CCN(C3)C(c3ccccc3)=O)n2CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.062 |
| logD: | 0.3955 |
| logSw: | -1.7807 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.747 |
| InChI Key: | XUNYJHGWAORTGD-MRXNPFEDSA-N |