1-(3-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(3-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
1-(3-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | E694-0023 |
| Compound Name: | 1-(3-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one |
| Molecular Weight: | 464.55 |
| Molecular Formula: | C23 H24 N6 O3 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)NCCCN1CCCC1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8369 |
| logD: | 2.8369 |
| logSw: | -3.3684 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.971 |
| InChI Key: | VQZHLFNWUYCPOQ-UHFFFAOYSA-N |