9-(ethylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
9-(ethylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
9-(ethylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 3807-2699 |
| Compound Name: | 9-(ethylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 404.55 |
| Molecular Formula: | C23 H20 N2 O S2 |
| Smiles: | CCSC1=Nc2c(C(N1c1cccc(C)c1)=O)c1CCc3ccccc3c1s2 |
| Stereo: | ACHIRAL |
| logP: | 6.1052 |
| logD: | 6.1046 |
| logSw: | -5.5456 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.9824 |
| InChI Key: | XUMVFQZWSUBFTR-UHFFFAOYSA-N |