ethyl 1,6-dimethyl-4-{4-[(2-phenylcyclopropane-1-carbonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1,6-dimethyl-4-{4-[(2-phenylcyclopropane-1-carbonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1,6-dimethyl-4-{4-[(2-phenylcyclopropane-1-carbonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V026-9683 |
| Compound Name: | ethyl 1,6-dimethyl-4-{4-[(2-phenylcyclopropane-1-carbonyl)amino]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccc(cc2)NC(C2CC2c2ccccc2)=O)NC(N(C)C=1C)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8931 |
| logD: | 3.893 |
| logSw: | -3.8834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.609 |
| InChI Key: | ULDQDYDKZYTNAJ-UHFFFAOYSA-N |