8-benzyl-9-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
8-benzyl-9-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
8-benzyl-9-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 3455-0417 |
| Compound Name: | 8-benzyl-9-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C24 H20 N2 O S2 |
| Smiles: | C=CCSC1=Nc2c(C(N1Cc1ccccc1)=O)c1CCc3ccccc3c1s2 |
| Stereo: | ACHIRAL |
| logP: | 6.3317 |
| logD: | 6.3317 |
| logSw: | -5.9026 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.5939 |
| InChI Key: | CRILEZVVHNJHKY-UHFFFAOYSA-N |