3-[2-(methanesulfinyl)-5-methylthiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Chemical Structure Depiction of
3-[2-(methanesulfinyl)-5-methylthiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
3-[2-(methanesulfinyl)-5-methylthiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Compound characteristics
| Compound ID: | 8017-6841 |
| Compound Name: | 3-[2-(methanesulfinyl)-5-methylthiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione |
| Molecular Weight: | 374.44 |
| Molecular Formula: | C17 H14 N2 O4 S2 |
| Smiles: | Cc1cc(C2C3C(C(N(C3=O)c3ccccc3)=O)ON=2)c(s1)S(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8958 |
| logD: | 1.8943 |
| logSw: | -2.8226 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.478 |
| InChI Key: | XTFMXONIEWIWNA-UHFFFAOYSA-N |