N-(5-chloro-2,4-dimethoxyphenyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
N-(5-chloro-2,4-dimethoxyphenyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Compound characteristics
| Compound ID: | G702-1191 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(thiophen-2-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine |
| Molecular Weight: | 441.94 |
| Molecular Formula: | C21 H20 Cl N5 O2 S |
| Smiles: | COc1cc(c(cc1NC1=C2CCCCC2=Nc2nc(c3cccs3)nn12)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.3205 |
| logD: | 5.317 |
| logSw: | -5.9179 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.474 |
| InChI Key: | CTPBQUDIYZQTHB-UHFFFAOYSA-N |