7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(3-methoxypropyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(3-methoxypropyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(3-methoxypropyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-1513 |
| Compound Name: | 7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(3-methoxypropyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C21 H22 Cl N5 O3 S |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3cc(ccc3n2nn1)[Cl])NCCCOC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8774 |
| logD: | 4.8774 |
| logSw: | -4.7399 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.073 |
| InChI Key: | GAXILAKHCIFTTO-UHFFFAOYSA-N |