[4-(3-fluoro-4-methoxybenzoyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepan-1-yl](pyridin-4-yl)methanone
Chemical Structure Depiction of
[4-(3-fluoro-4-methoxybenzoyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepan-1-yl](pyridin-4-yl)methanone
[4-(3-fluoro-4-methoxybenzoyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepan-1-yl](pyridin-4-yl)methanone
Compound characteristics
| Compound ID: | SA53-0983 |
| Compound Name: | [4-(3-fluoro-4-methoxybenzoyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepan-1-yl](pyridin-4-yl)methanone |
| Molecular Weight: | 438.46 |
| Molecular Formula: | C22 H23 F N6 O3 |
| Smiles: | Cc1nc(C2CN(CCCN2C(c2ccncc2)=O)C(c2ccc(c(c2)F)OC)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8529 |
| logD: | 0.8499 |
| logSw: | -1.3442 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.758 |
| InChI Key: | OJBFKNPVOWVKIL-SFHVURJKSA-N |