1-(3-fluoro-4-methylbenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
Chemical Structure Depiction of
1-(3-fluoro-4-methylbenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
1-(3-fluoro-4-methylbenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
Compound characteristics
| Compound ID: | T599-3209 |
| Compound Name: | 1-(3-fluoro-4-methylbenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine |
| Molecular Weight: | 334.41 |
| Molecular Formula: | C17 H19 F N2 O2 S |
| Smiles: | Cc1ccc(cc1F)S(N1CCCN(C)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1402 |
| logD: | 3.1402 |
| logSw: | -3.3737 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.351 |
| InChI Key: | BRKKWUYDIMETKW-UHFFFAOYSA-N |