tert-butyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
tert-butyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
tert-butyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4383-0298 |
| Compound Name: | tert-butyl 6-methyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C19 H26 N2 O5 S |
| Smiles: | CC1=C(C(c2cc(c(c(c2)OC)OC)OC)NC(N1)=S)C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9521 |
| logD: | 2.936 |
| logSw: | -3.3931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.515 |
| InChI Key: | KSQSGWVOVJVZBR-OAHLLOKOSA-N |