methyl 4-(N-benzoyl-N-methylalanyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-(N-benzoyl-N-methylalanyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-(N-benzoyl-N-methylalanyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-9865 |
| Compound Name: | methyl 4-(N-benzoyl-N-methylalanyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C19 H22 N2 O4 |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(C)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1967 |
| logD: | 2.1967 |
| logSw: | -2.5981 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.454 |
| InChI Key: | RJIGSZAQDRQPIG-ZDUSSCGKSA-N |