ethyl 6-({[1-(adamantan-1-yl)ethyl]amino}methyl)-4-(2,5-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-({[1-(adamantan-1-yl)ethyl]amino}methyl)-4-(2,5-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-({[1-(adamantan-1-yl)ethyl]amino}methyl)-4-(2,5-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8016-0104 |
| Compound Name: | ethyl 6-({[1-(adamantan-1-yl)ethyl]amino}methyl)-4-(2,5-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C28 H39 N3 O3 |
| Smiles: | CCOC(C1C(c2cc(C)ccc2C)NC(NC=1CNC(C)C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9058 |
| logD: | 1.3329 |
| logSw: | -4.5457 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.805 |
| InChI Key: | XDRMFTDUKASQOT-UHFFFAOYSA-N |