ethyl 4-[3-(3-nitrophenyl)-7-oxo-5-sulfanylidenedihydro-1H,3H-imidazo[1,5-c][1,3]thiazol-6(5H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[3-(3-nitrophenyl)-7-oxo-5-sulfanylidenedihydro-1H,3H-imidazo[1,5-c][1,3]thiazol-6(5H)-yl]benzoate
ethyl 4-[3-(3-nitrophenyl)-7-oxo-5-sulfanylidenedihydro-1H,3H-imidazo[1,5-c][1,3]thiazol-6(5H)-yl]benzoate
Compound characteristics
| Compound ID: | 8015-6631 |
| Compound Name: | ethyl 4-[3-(3-nitrophenyl)-7-oxo-5-sulfanylidenedihydro-1H,3H-imidazo[1,5-c][1,3]thiazol-6(5H)-yl]benzoate |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C20 H17 N3 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)N1C(C2CSC(c3cccc(c3)[N+]([O-])=O)N2C1=S)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4986 |
| logD: | 3.4986 |
| logSw: | -3.7839 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 72.974 |
| InChI Key: | IUNJKFPSVOMUDO-UHFFFAOYSA-N |