7-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | D344-9028 |
| Compound Name: | 7-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 391.86 |
| Molecular Formula: | C15 H10 Cl N5 O2 S2 |
| Smiles: | CC1=NN2C(=NC(CSc3nnc(c4cccc(c4)[Cl])o3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.072 |
| logD: | 3.0696 |
| logSw: | -3.4848 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.541 |
| InChI Key: | LMYKZXQLYFTUQO-UHFFFAOYSA-N |