3-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Chemical Structure Depiction of
3-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
3-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Compound characteristics
| Compound ID: | 8017-6843 |
| Compound Name: | 3-[5-methyl-2-(methylsulfanyl)thiophen-3-yl]-5-phenyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C17 H14 N2 O3 S2 |
| Smiles: | Cc1cc(C2C3C(C(N(C3=O)c3ccccc3)=O)ON=2)c(SC)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9687 |
| logD: | 2.9671 |
| logSw: | -3.4122 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.709 |
| InChI Key: | MGCAIUANCUNWSS-UHFFFAOYSA-N |