3-(4-ethylbenzene-1-sulfonyl)-N-(3-methylbutyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(4-ethylbenzene-1-sulfonyl)-N-(3-methylbutyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(4-ethylbenzene-1-sulfonyl)-N-(3-methylbutyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-1002 |
| Compound Name: | 3-(4-ethylbenzene-1-sulfonyl)-N-(3-methylbutyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 423.54 |
| Molecular Formula: | C22 H25 N5 O2 S |
| Smiles: | CCc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)NCCC(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5468 |
| logD: | 5.5468 |
| logSw: | -5.7966 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.73 |
| InChI Key: | DHJKPCRQIODSDP-UHFFFAOYSA-N |