3-cyclopropyl-N-(3-fluorophenyl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
3-cyclopropyl-N-(3-fluorophenyl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepine-7-carboxamide
3-cyclopropyl-N-(3-fluorophenyl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S584-0342 |
| Compound Name: | 3-cyclopropyl-N-(3-fluorophenyl)-5,6,8,9-tetrahydro-7H-[1,2,4]triazolo[4,3-d][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 315.35 |
| Molecular Formula: | C16 H18 F N5 O |
| Smiles: | C1CN(CCn2c1nnc2C1CC1)C(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8326 |
| logD: | 1.742 |
| logSw: | -2.2397 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.063 |
| InChI Key: | CRFSUVMZENOESL-UHFFFAOYSA-N |