N-(3,3-diethoxypropyl)-3-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}benzamide
Chemical Structure Depiction of
N-(3,3-diethoxypropyl)-3-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}benzamide
N-(3,3-diethoxypropyl)-3-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}benzamide
Compound characteristics
| Compound ID: | C685-0122 |
| Compound Name: | N-(3,3-diethoxypropyl)-3-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}benzamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C19 H27 N3 O5 S2 |
| Smiles: | CCOC(CCNC(c1cccc(c1)NC1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)=O)OCC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.409 |
| logD: | 1.409 |
| logSw: | -2.4245 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.522 |
| InChI Key: | VKKRGZKIQYPYII-UHFFFAOYSA-N |