2-tert-butyl-7-[(dibenzylamino)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-tert-butyl-7-[(dibenzylamino)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-tert-butyl-7-[(dibenzylamino)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2016 |
| Compound Name: | 2-tert-butyl-7-[(dibenzylamino)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | CC(C)(C)C1=NN2C(=NC(CN(Cc3ccccc3)Cc3ccccc3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3984 |
| logD: | 4.3686 |
| logSw: | -4.3053 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.982 |
| InChI Key: | OCEYXCXJZKGCPF-UHFFFAOYSA-N |