ethyl 4-[4-(4-hexylbenzamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-hexylbenzamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-[4-(4-hexylbenzamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V009-8240 |
| Compound Name: | ethyl 4-[4-(4-hexylbenzamido)phenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C28 H35 N3 O3 S |
| Smiles: | CCCCCCc1ccc(cc1)C(Nc1ccc(cc1)C1C(=C(C)N(C)C(N1)=S)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2991 |
| logD: | 6.299 |
| logSw: | -5.2413 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.357 |
| InChI Key: | FVKQZOFMOCWFNN-RUZDIDTESA-N |