N-{[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
Chemical Structure Depiction of
N-{[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
N-{[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
Compound characteristics
| Compound ID: | Y042-2670 |
| Compound Name: | N-{[3-(2-chloro-6-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide |
| Molecular Weight: | 443.82 |
| Molecular Formula: | C20 H15 Cl F N5 O4 |
| Smiles: | C(C1C(Nc2ccccc2C(N1)=O)=O)C(NCc1nc(c2c(cccc2[Cl])F)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2445 |
| logD: | 2.2321 |
| logSw: | -3.6545 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.765 |
| InChI Key: | NOFQRVKUTCIHDN-AWEZNQCLSA-N |