propan-2-yl 4-{3-[(3-ethylphenyl)carbamamido]phenyl}-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-{3-[(3-ethylphenyl)carbamamido]phenyl}-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
propan-2-yl 4-{3-[(3-ethylphenyl)carbamamido]phenyl}-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-3995 |
| Compound Name: | propan-2-yl 4-{3-[(3-ethylphenyl)carbamamido]phenyl}-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C25 H30 N4 O4 |
| Smiles: | CCc1cccc(c1)NC(Nc1cccc(c1)C1C(=C(C)N(C)C(N1)=O)C(=O)OC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9332 |
| logD: | 4.9288 |
| logSw: | -4.5543 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.411 |
| InChI Key: | ODDVWXFKJZFUOS-QFIPXVFZSA-N |