7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(2-phenylethyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(2-phenylethyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(2-phenylethyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-1470 |
| Compound Name: | 7-chloro-3-(3,4-dimethylbenzene-1-sulfonyl)-N-(2-phenylethyl)[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(c3cc(ccc3n2nn1)[Cl])NCCc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1186 |
| logD: | 6.1186 |
| logSw: | -6.1018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.459 |
| InChI Key: | NEUPPIJLEQNLHU-UHFFFAOYSA-N |