4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}-N-(4-phenoxyphenyl)benzamide
Chemical Structure Depiction of
4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}-N-(4-phenoxyphenyl)benzamide
4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}-N-(4-phenoxyphenyl)benzamide
Compound characteristics
| Compound ID: | K248-0151 |
| Compound Name: | 4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}-N-(4-phenoxyphenyl)benzamide |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C24 H21 N3 O4 S2 |
| Smiles: | C1[C@@H]2[C@H](CS1(=O)=O)SC(Nc1ccc(cc1)C(Nc1ccc(cc1)Oc1ccccc1)=O)=N2 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1266 |
| logD: | 4.1264 |
| logSw: | -4.3723 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.18 |
| InChI Key: | BJWDCGNOHBLVIL-UHFFFAOYSA-N |