3-benzyl-2-(butylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3-benzyl-2-(butylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
3-benzyl-2-(butylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 2969-0191 |
| Compound Name: | 3-benzyl-2-(butylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 370.53 |
| Molecular Formula: | C20 H22 N2 O S2 |
| Smiles: | CCCCSC1=Nc2c(C(N1Cc1ccccc1)=O)c1CCCc1s2 |
| Stereo: | ACHIRAL |
| logP: | 5.7283 |
| logD: | 5.7283 |
| logSw: | -5.3765 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.2314 |
| InChI Key: | NFECMUQDQNNTCA-UHFFFAOYSA-N |