propan-2-yl 4-[3-(3,5-dimethoxybenzamido)phenyl]-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-[3-(3,5-dimethoxybenzamido)phenyl]-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
propan-2-yl 4-[3-(3,5-dimethoxybenzamido)phenyl]-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V014-0338 |
| Compound Name: | propan-2-yl 4-[3-(3,5-dimethoxybenzamido)phenyl]-1-ethyl-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CCN1C(C)=C(C(c2cccc(c2)NC(c2cc(cc(c2)OC)OC)=O)NC1=S)C(=O)OC(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7487 |
| logD: | 4.7486 |
| logSw: | -4.5008 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.083 |
| InChI Key: | ORNRCQINGWCLLG-HSZRJFAPSA-N |