[3-(1-benzoylpyrrolidin-3-yl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl](phenyl)methanone
Chemical Structure Depiction of
[3-(1-benzoylpyrrolidin-3-yl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl](phenyl)methanone
[3-(1-benzoylpyrrolidin-3-yl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl](phenyl)methanone
Compound characteristics
| Compound ID: | S841-0136 |
| Compound Name: | [3-(1-benzoylpyrrolidin-3-yl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepin-7-yl](phenyl)methanone |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C24 H25 N5 O2 |
| Smiles: | C1CN(CC1c1nnc2CCN(CCn12)C(c1ccccc1)=O)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4537 |
| logD: | 1.4536 |
| logSw: | -1.6479 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.667 |
| InChI Key: | UHGYZCGERDFUBB-FQEVSTJZSA-N |