2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
| Compound ID: | D205-0124 |
| Compound Name: | 2-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
| Molecular Weight: | 371.74 |
| Molecular Formula: | C16 H10 Cl N5 O4 |
| Smiles: | Cc1c(c(C)n2c(n1)nc(n2)N1C(c2ccc(cc2C1=O)C(O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4394 |
| logD: | -1.5382 |
| logSw: | -3.1094 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.353 |
| InChI Key: | JLDSZBKYLQWJDV-UHFFFAOYSA-N |