N-(butan-2-yl)-2-({3-[(furan-2-yl)methyl]-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(butan-2-yl)-2-({3-[(furan-2-yl)methyl]-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
N-(butan-2-yl)-2-({3-[(furan-2-yl)methyl]-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K286-4320 |
| Compound Name: | N-(butan-2-yl)-2-({3-[(furan-2-yl)methyl]-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)acetamide |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C22 H22 N4 O3 S3 |
| Smiles: | CCC(C)NC(CSC1=NC2=C(C(N1c1ccccc1)=O)SC(N2Cc1ccco1)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6624 |
| logD: | 3.6624 |
| logSw: | -3.8452 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.499 |
| InChI Key: | ISGGFSXPQVLLIB-AWEZNQCLSA-N |