2-methylcyclopentyl 4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-methylcyclopentyl 4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-methylcyclopentyl 4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-0668 |
| Compound Name: | 2-methylcyclopentyl 4-[4-(dimethylamino)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 373.52 |
| Molecular Formula: | C20 H27 N3 O2 S |
| Smiles: | CC1CCCC1OC(C1C(c2ccc(cc2)N(C)C)NC(NC=1C)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2774 |
| logD: | 3.247 |
| logSw: | -3.6348 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.872 |
| InChI Key: | HKTLETRTGJBYFO-UHFFFAOYSA-N |