ethyl 4-(4-{[2,6-di(propan-2-yl)phenyl]carbamamido}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-{[2,6-di(propan-2-yl)phenyl]carbamamido}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-{[2,6-di(propan-2-yl)phenyl]carbamamido}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V015-0405 |
| Compound Name: | ethyl 4-(4-{[2,6-di(propan-2-yl)phenyl]carbamamido}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 508.68 |
| Molecular Formula: | C28 H36 N4 O3 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)NC(Nc2c(cccc2C(C)C)C(C)C)=O)NC(N(C)C=1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6184 |
| logD: | 4.6184 |
| logSw: | -4.2256 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.174 |
| InChI Key: | GNAISMUFDXLESL-XMMPIXPASA-N |