ethyl 6-({4-[(2-methoxyphenyl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1-methyl-4-(2-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-({4-[(2-methoxyphenyl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1-methyl-4-(2-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-({4-[(2-methoxyphenyl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1-methyl-4-(2-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V011-0313 |
| Compound Name: | ethyl 6-({4-[(2-methoxyphenyl)carbamoyl]-1,4-diazepan-1-yl}methyl)-1-methyl-4-(2-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 535.64 |
| Molecular Formula: | C29 H37 N5 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccccc2C)NC(N(C)C=1CN1CCCN(CC1)C(Nc1ccccc1OC)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5351 |
| logD: | 0.2586 |
| logSw: | -3.5027 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.063 |
| InChI Key: | PZVKIHVWEZKANQ-AREMUKBSSA-N |