3-benzyl-10-bromo-5-phenyl-3,5,5a,11b-tetrahydro-2H,6H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-2,6-dione
Chemical Structure Depiction of
3-benzyl-10-bromo-5-phenyl-3,5,5a,11b-tetrahydro-2H,6H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-2,6-dione
3-benzyl-10-bromo-5-phenyl-3,5,5a,11b-tetrahydro-2H,6H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-2,6-dione
Compound characteristics
| Compound ID: | 5499-0582 |
| Compound Name: | 3-benzyl-10-bromo-5-phenyl-3,5,5a,11b-tetrahydro-2H,6H-[1]benzopyrano[4',3':4,5]thiopyrano[2,3-d][1,3]thiazole-2,6-dione |
| Molecular Weight: | 536.47 |
| Molecular Formula: | C26 H18 Br N O3 S2 |
| Smiles: | C(c1ccccc1)N1C2=C(C3C(C(c4ccccc4)S2)C(=O)Oc2ccc(cc23)[Br])SC1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.2197 |
| logD: | 7.2197 |
| logSw: | -6.1652 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 36.794 |
| InChI Key: | IBVVMBLZHPMSGS-UHFFFAOYSA-N |