7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0191 |
| Compound Name: | 7-[4-(3-chlorobenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 485.95 |
| Molecular Formula: | C21 H20 Cl N7 O3 S |
| Smiles: | COc1cccc(c1)n1c2c(c(ncn2)N2CCN(CC2)S(c2cccc(c2)[Cl])(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.6601 |
| logD: | 3.6601 |
| logSw: | -3.9282 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.688 |
| InChI Key: | YEIGBQKDULGROC-UHFFFAOYSA-N |