2-(9-tert-butyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(9-tert-butyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-[(3-methoxyphenyl)methyl]acetamide
2-(9-tert-butyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L908-0641 |
| Compound Name: | 2-(9-tert-butyl-2-oxo-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3(2H)-yl)-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C25 H29 N5 O3 S |
| Smiles: | CC(C)(C)C1CCc2c3C4=NC(N(CC(NCc5cccc(c5)OC)=O)N4C=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3904 |
| logD: | -0.5435 |
| logSw: | -4.5451 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.806 |
| InChI Key: | CHUAHGXOVCPXBV-MRXNPFEDSA-N |