N-[(furan-2-yl)methyl]-8,8-dimethyl-10-oxo-3-phenyl-3,8,9,10-tetrahydro-6H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-8,8-dimethyl-10-oxo-3-phenyl-3,8,9,10-tetrahydro-6H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[(furan-2-yl)methyl]-8,8-dimethyl-10-oxo-3-phenyl-3,8,9,10-tetrahydro-6H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 8640-0040 |
| Compound Name: | N-[(furan-2-yl)methyl]-8,8-dimethyl-10-oxo-3-phenyl-3,8,9,10-tetrahydro-6H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 475.53 |
| Molecular Formula: | C24 H21 N5 O4 S |
| Smiles: | [H]N(Cc1ccco1)C(C1=NN2C(=Nc3c(C2=O)c2CC(C)(C)OCc2s3)N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4785 |
| logD: | 3.4784 |
| logSw: | -3.9323 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.329 |
| InChI Key: | NKBRRPYIHZIJQQ-UHFFFAOYSA-N |