1-(4-bromophenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
Chemical Structure Depiction of
1-(4-bromophenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
1-(4-bromophenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole
Compound characteristics
| Compound ID: | C595-0592 |
| Compound Name: | 1-(4-bromophenyl)-5-methyl-4-[4-(propan-2-yl)benzene-1-sulfonyl]-1H-1,2,3-triazole |
| Molecular Weight: | 420.33 |
| Molecular Formula: | C18 H18 Br N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)S(c1c(C)n(c2ccc(cc2)[Br])nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0521 |
| logD: | 5.0521 |
| logSw: | -4.6668 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.357 |
| InChI Key: | IBCOIVUNRSKYKH-UHFFFAOYSA-N |