N-[3-(methylsulfanyl)phenyl]-3-[4-(propan-2-yl)benzene-1-sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-3-[4-(propan-2-yl)benzene-1-sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-[3-(methylsulfanyl)phenyl]-3-[4-(propan-2-yl)benzene-1-sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0672 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-3-[4-(propan-2-yl)benzene-1-sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 489.62 |
| Molecular Formula: | C25 H23 N5 O2 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)Nc1cccc(c1)SC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.396 |
| logD: | 6.396 |
| logSw: | -6.1069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.295 |
| InChI Key: | JCXUXONZXQGYHK-UHFFFAOYSA-N |