3-[(2-chlorophenyl)methyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(2-chlorophenyl)methyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0181 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 406.95 |
| Molecular Formula: | C19 H19 Cl N2 O2 S2 |
| Smiles: | CC(C)(C)C(CSC1=Nc2ccsc2C(N1Cc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9988 |
| logD: | 4.9988 |
| logSw: | -4.9815 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.308 |
| InChI Key: | PBYHYPZDMHIIHA-UHFFFAOYSA-N |