N-(3-chloro-2-methylphenyl)-2-(1-oxo-1,7,8,9,10,11-hexahydro-2H-cyclohepta[3,4]pyrazolo[1,5-a]pyrazin-2-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-(1-oxo-1,7,8,9,10,11-hexahydro-2H-cyclohepta[3,4]pyrazolo[1,5-a]pyrazin-2-yl)acetamide
N-(3-chloro-2-methylphenyl)-2-(1-oxo-1,7,8,9,10,11-hexahydro-2H-cyclohepta[3,4]pyrazolo[1,5-a]pyrazin-2-yl)acetamide
Compound characteristics
| Compound ID: | S446-0086 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-(1-oxo-1,7,8,9,10,11-hexahydro-2H-cyclohepta[3,4]pyrazolo[1,5-a]pyrazin-2-yl)acetamide |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C20 H21 Cl N4 O2 |
| Smiles: | Cc1c(cccc1[Cl])NC(CN1C=Cn2c(C1=O)c1CCCCCc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9083 |
| logD: | 2.9081 |
| logSw: | -3.3762 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.222 |
| InChI Key: | GXQOPMSDTWPIMZ-UHFFFAOYSA-N |