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)-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
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)-N-(3-methylbutyl)acetamide
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)-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | K286-4321 |
| Compound Name: | 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)-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C23 H24 N4 O3 S3 |
| Smiles: | CC(C)CCNC(CSC1=NC2=C(C(N1c1ccccc1)=O)SC(N2Cc1ccco1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0641 |
| logD: | 4.0641 |
| logSw: | -4.0346 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.899 |
| InChI Key: | IAIPLRFLLMCVEF-UHFFFAOYSA-N |