7-({[(4-chlorophenyl)methyl](2-methoxyethyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[(4-chlorophenyl)methyl](2-methoxyethyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({[(4-chlorophenyl)methyl](2-methoxyethyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2297 |
| Compound Name: | 7-({[(4-chlorophenyl)methyl](2-methoxyethyl)amino}methyl)-2-cyclohexyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 447 |
| Molecular Formula: | C22 H27 Cl N4 O2 S |
| Smiles: | COCCN(CC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)Cc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4366 |
| logD: | 4.4242 |
| logSw: | -4.5264 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.495 |
| InChI Key: | UBPAKQKJVCLDRK-UHFFFAOYSA-N |