N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0157 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 492 |
| Molecular Formula: | C25 H22 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3ccccc3n2nn1)NCCc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0071 |
| logD: | 6.0071 |
| logSw: | -6.1995 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.459 |
| InChI Key: | PBDRGNNKUIMONE-UHFFFAOYSA-N |