[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(2-phenoxypropanamido)benzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(2-phenoxypropanamido)benzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(2-phenoxypropanamido)benzoate
Compound characteristics
| Compound ID: | G357-0458 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(2-phenoxypropanamido)benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccccc3NC(C(C)Oc3ccccc3)=O)=O)=CC2=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3417 |
| logD: | 4.315 |
| logSw: | -4.4128 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.582 |
| InChI Key: | VLFVRLPPOAOLTJ-INIZCTEOSA-N |