N-(3-chloro-4-methylphenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-(3-chloro-4-methylphenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0553 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C23 H18 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)Nc1ccc(C)c(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4105 |
| logD: | 6.4105 |
| logSw: | -6.3884 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.295 |
| InChI Key: | NPWNPHQUZWFVPP-UHFFFAOYSA-N |