7-({benzyl[(4-methylphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({benzyl[(4-methylphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({benzyl[(4-methylphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2611 |
| Compound Name: | 7-({benzyl[(4-methylphenyl)methyl]amino}methyl)-2-ethyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C23 H24 N4 O S |
| Smiles: | CCC1=NN2C(=NC(CN(Cc3ccccc3)Cc3ccc(C)cc3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3586 |
| logD: | 4.2628 |
| logSw: | -4.2279 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.886 |
| InChI Key: | VQTZMJXDEHZCFP-UHFFFAOYSA-N |