5-(4-nitrophenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-(4-nitrophenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
5-(4-nitrophenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8008-4269 |
| Compound Name: | 5-(4-nitrophenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one |
| Molecular Weight: | 384.43 |
| Molecular Formula: | C17 H12 N4 O3 S2 |
| Smiles: | c1ccc(cc1)N1C2=C(C(NC(c3ccc(cc3)[N+]([O-])=O)N2)=O)SC1=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9546 |
| logD: | 2.9544 |
| logSw: | -3.51 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.553 |
| InChI Key: | VETAONACIBLEKE-CQSZACIVSA-N |