2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-cyclohexylacetamide
Chemical Structure Depiction of
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-cyclohexylacetamide
2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | F831-0764 |
| Compound Name: | 2-{[9-(4-chlorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-cyclohexylacetamide |
| Molecular Weight: | 440.95 |
| Molecular Formula: | C21 H21 Cl N6 O S |
| Smiles: | C1CCC(CC1)NC(CSc1nnc2c3cc(c4ccc(cc4)[Cl])nn3ccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7114 |
| logD: | 3.6411 |
| logSw: | -4.3079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.505 |
| InChI Key: | CCIMNMXUPBCPQV-UHFFFAOYSA-N |