6-[2-(4-chlorophenyl)-2-oxoethyl]-3-(4-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[2-(4-chlorophenyl)-2-oxoethyl]-3-(4-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[2-(4-chlorophenyl)-2-oxoethyl]-3-(4-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C656-0699 |
| Compound Name: | 6-[2-(4-chlorophenyl)-2-oxoethyl]-3-(4-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 395.8 |
| Molecular Formula: | C19 H14 Cl N5 O3 |
| Smiles: | COc1ccc(cc1)n1c2c(C(N(CC(c3ccc(cc3)[Cl])=O)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.3704 |
| logD: | 2.3704 |
| logSw: | -3.044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.949 |
| InChI Key: | BTXVKIPOAXCCEU-UHFFFAOYSA-N |