2-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
2-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide
Compound characteristics
Compound ID: | C785-4002 |
Compound Name: | 2-(2,5-diethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[(2-methylphenyl)methyl]acetamide |
Molecular Weight: | 408.52 |
Molecular Formula: | C22 H24 N4 O2 S |
Smiles: | CCC1=NN(CC(NCc2ccccc2C)=O)C(c2cc3c(cc(CC)s3)n12)=O |
Stereo: | ACHIRAL |
logP: | 4.4311 |
logD: | 4.4311 |
logSw: | -4.248 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.958 |
InChI Key: | OEARYSKYVSJAGO-UHFFFAOYSA-N |