7-bromo-5-(4-fluorophenyl)-4-[4-(piperidine-1-sulfonyl)benzoyl]-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-5-(4-fluorophenyl)-4-[4-(piperidine-1-sulfonyl)benzoyl]-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-5-(4-fluorophenyl)-4-[4-(piperidine-1-sulfonyl)benzoyl]-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0243 |
| Compound Name: | 7-bromo-5-(4-fluorophenyl)-4-[4-(piperidine-1-sulfonyl)benzoyl]-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 586.48 |
| Molecular Formula: | C27 H25 Br F N3 O4 S |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)C(N1CC(Nc2ccc(cc2C1c1ccc(cc1)F)[Br])=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7893 |
| logD: | 4.7893 |
| logSw: | -4.7216 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.737 |
| InChI Key: | JOUQEWVVRWZSAZ-SANMLTNESA-N |