3-(4-methylphenyl)-7-[4-(naphthalene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
3-(4-methylphenyl)-7-[4-(naphthalene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
3-(4-methylphenyl)-7-[4-(naphthalene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0045 |
| Compound Name: | 3-(4-methylphenyl)-7-[4-(naphthalene-2-sulfonyl)piperazin-1-yl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 485.57 |
| Molecular Formula: | C25 H23 N7 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)S(c2ccc3ccccc3c2)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.4488 |
| logD: | 4.4488 |
| logSw: | -4.4061 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.873 |
| InChI Key: | XCTZRWMIMPUDLU-UHFFFAOYSA-N |