2-cyclohexyl-7-({ethyl[(4-fluorophenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-cyclohexyl-7-({ethyl[(4-fluorophenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-cyclohexyl-7-({ethyl[(4-fluorophenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2036 |
| Compound Name: | 2-cyclohexyl-7-({ethyl[(4-fluorophenyl)methyl]amino}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C21 H25 F N4 O S |
| Smiles: | CCN(CC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.3055 |
| logD: | 4.1611 |
| logSw: | -4.1392 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.899 |
| InChI Key: | NUMNAVBVRXNLGZ-UHFFFAOYSA-N |