1-(3-bromobenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
Chemical Structure Depiction of
1-(3-bromobenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
1-(3-bromobenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
Compound characteristics
| Compound ID: | T599-3180 |
| Compound Name: | 1-(3-bromobenzene-1-sulfonyl)-5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine |
| Molecular Weight: | 381.29 |
| Molecular Formula: | C16 H17 Br N2 O2 S |
| Smiles: | CN1CCCN(c2ccccc12)S(c1cccc(c1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2114 |
| logD: | 3.2114 |
| logSw: | -3.6185 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.351 |
| InChI Key: | XIJYATBMRAJEIF-UHFFFAOYSA-N |