8,10-dibromo-5a-methyl-3,5a,6,11b-tetrahydro-2H,5H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one
Chemical Structure Depiction of
8,10-dibromo-5a-methyl-3,5a,6,11b-tetrahydro-2H,5H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one
8,10-dibromo-5a-methyl-3,5a,6,11b-tetrahydro-2H,5H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one
Compound characteristics
| Compound ID: | 8016-9987 |
| Compound Name: | 8,10-dibromo-5a-methyl-3,5a,6,11b-tetrahydro-2H,5H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazol-2-one |
| Molecular Weight: | 449.18 |
| Molecular Formula: | C14 H11 Br2 N O2 S2 |
| Smiles: | CC12COc3c(cc(cc3[Br])[Br])C2C2=C(NC(=O)S2)SC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2597 |
| logD: | 5.2596 |
| logSw: | -5.0208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.2761 |
| InChI Key: | AYCROMNCFXIXCY-UHFFFAOYSA-N |