3-(4-tert-butylbenzene-1-sulfonyl)-N-(2,3-dimethylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(4-tert-butylbenzene-1-sulfonyl)-N-(2,3-dimethylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(4-tert-butylbenzene-1-sulfonyl)-N-(2,3-dimethylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0766 |
| Compound Name: | 3-(4-tert-butylbenzene-1-sulfonyl)-N-(2,3-dimethylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 485.61 |
| Molecular Formula: | C27 H27 N5 O2 S |
| Smiles: | Cc1cccc(c1C)Nc1c2ccccc2n2c(c(nn2)S(c2ccc(cc2)C(C)(C)C)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3387 |
| logD: | 7.3387 |
| logSw: | -6.1842 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.597 |
| InChI Key: | AFVLGQKZRSGWGW-UHFFFAOYSA-N |