cycloheptyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
cycloheptyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
cycloheptyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 2191-2806 |
Compound Name: | cycloheptyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 388.46 |
Molecular Formula: | C21 H28 N2 O5 |
Smiles: | CCOc1cc(ccc1O)C1C(=C(C)NC(N1)=O)C(=O)OC1CCCCCC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4618 |
logD: | 3.3116 |
logSw: | -3.1856 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 79.865 |
InChI Key: | YTQISNLMOPNCAU-LJQANCHMSA-N |