N-(4-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)amino]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)amino]-1H-1,2,3-triazole-4-carboxamide
N-(4-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)amino]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | Y010-0441 |
| Compound Name: | N-(4-bromophenyl)-5-[(4-methylbenzene-1-sulfonyl)amino]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 436.28 |
| Molecular Formula: | C16 H14 Br N5 O3 S |
| Smiles: | Cc1ccc(cc1)S(Nc1c(C(Nc2ccc(cc2)[Br])=O)nn[nH]1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0878 |
| logD: | 0.9385 |
| logSw: | -3.5433 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.292 |
| InChI Key: | OHPSBVZWKNQWQR-UHFFFAOYSA-N |