4-[7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylaniline
Chemical Structure Depiction of
4-[7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylaniline
4-[7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylaniline
Compound characteristics
| Compound ID: | K832-2845 |
| Compound Name: | 4-[7-(4-chlorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N,N-dimethylaniline |
| Molecular Weight: | 455.95 |
| Molecular Formula: | C26 H22 Cl N5 O |
| Smiles: | CN(C)c1ccc(cc1)C1C2C(c3ccc(cc3)[Cl])n3c(NC=2c2ccccc2O1)ncn3 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5562 |
| logD: | 5.5516 |
| logSw: | -6.2674 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.412 |
| InChI Key: | KQVNSCKZIQYGDT-UHFFFAOYSA-N |