ethyl 4-[2-(benzyloxy)naphthalen-1-yl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(benzyloxy)naphthalen-1-yl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-[2-(benzyloxy)naphthalen-1-yl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 3339-3869 |
Compound Name: | ethyl 4-[2-(benzyloxy)naphthalen-1-yl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 446.57 |
Molecular Formula: | C26 H26 N2 O3 S |
Smiles: | CCOC(C1C(c2c(ccc3ccccc23)OCc2ccccc2)NC(N(C)C=1C)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1743 |
logD: | 5.1705 |
logSw: | -6.0303 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.309 |
InChI Key: | DMQFWNZFHTUUMJ-XMMPIXPASA-N |