ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V021-5937 |
| Compound Name: | ethyl 1-ethyl-4-(2-methoxyphenyl)-2-oxo-6-{[4-(propylcarbamoyl)-1,4-diazepan-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 501.63 |
| Molecular Formula: | C26 H39 N5 O5 |
| Smiles: | CCCNC(N1CCCN(CC1)CC1=C(C(c2ccccc2OC)NC(N1CC)=O)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9993 |
| logD: | -0.7108 |
| logSw: | -3.2275 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.155 |
| InChI Key: | FLCVLKPSCHBXJY-QHCPKHFHSA-N |