ethyl 4-(2,5-dimethoxyphenyl)-1-ethyl-2-oxo-6-({4-[(propan-2-yl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,5-dimethoxyphenyl)-1-ethyl-2-oxo-6-({4-[(propan-2-yl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,5-dimethoxyphenyl)-1-ethyl-2-oxo-6-({4-[(propan-2-yl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V015-8757 |
| Compound Name: | ethyl 4-(2,5-dimethoxyphenyl)-1-ethyl-2-oxo-6-({4-[(propan-2-yl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 531.65 |
| Molecular Formula: | C27 H41 N5 O6 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCCN(CC2)C(NC(C)C)=O)=C(C(c2cc(ccc2OC)OC)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9305 |
| logD: | -0.7797 |
| logSw: | -3.3304 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.832 |
| InChI Key: | ALERQFQEVDEEFA-XMMPIXPASA-N |