3-(2,5-dimethylbenzene-1-sulfonyl)-N-[4-(propan-2-yl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(2,5-dimethylbenzene-1-sulfonyl)-N-[4-(propan-2-yl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(2,5-dimethylbenzene-1-sulfonyl)-N-[4-(propan-2-yl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0853 |
| Compound Name: | 3-(2,5-dimethylbenzene-1-sulfonyl)-N-[4-(propan-2-yl)phenyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C26 H25 N5 O2 S |
| Smiles: | CC(C)c1ccc(cc1)Nc1c2ccccc2n2c(c(nn2)S(c2cc(C)ccc2C)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.5355 |
| logD: | 6.5355 |
| logSw: | -5.9902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.295 |
| InChI Key: | JMSSPVKDHMTBOR-UHFFFAOYSA-N |