1-(3-{[7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(3-{[7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
1-(3-{[7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | C718-2372 |
| Compound Name: | 1-(3-{[7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}propyl)pyrrolidin-2-one |
| Molecular Weight: | 513.02 |
| Molecular Formula: | C24 H25 Cl N6 O3 S |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3cc(ccc3n2nn1)[Cl])NCCCN1CCCC1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0088 |
| logD: | 4.0088 |
| logSw: | -4.3421 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.971 |
| InChI Key: | APBGGONBJJRNTO-UHFFFAOYSA-N |