[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-(2-phenoxyacetamido)benzoate
Chemical Structure Depiction of
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-(2-phenoxyacetamido)benzoate
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-(2-phenoxyacetamido)benzoate
Compound characteristics
| Compound ID: | G357-0775 |
| Compound Name: | [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-(2-phenoxyacetamido)benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CC(C)CC1=NN2C(=NC(COC(c3ccc(cc3)NC(COc3ccccc3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.5831 |
| logD: | 4.5805 |
| logSw: | -4.3875 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.68 |
| InChI Key: | BNJQJZZNNBGDAZ-UHFFFAOYSA-N |