N-(4-methylcyclohexyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(4-methylcyclohexyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
N-(4-methylcyclohexyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | E020-0461 |
| Compound Name: | N-(4-methylcyclohexyl)-2-(4-methyl-1-oxopyrrolo[1,2-d][1,2,4]triazin-2(1H)-yl)acetamide |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C16 H22 N4 O2 |
| Smiles: | CC1CCC(CC1)NC(CN1C(c2cccn2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7392 |
| logD: | 2.7392 |
| logSw: | -2.9263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.495 |
| InChI Key: | VHVHNKHTTUVSPK-UHFFFAOYSA-N |