ethyl 4-{N-(tert-butylcarbamoyl)-N-[(4-fluorophenyl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-(tert-butylcarbamoyl)-N-[(4-fluorophenyl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-(tert-butylcarbamoyl)-N-[(4-fluorophenyl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V006-2234 |
| Compound Name: | ethyl 4-{N-(tert-butylcarbamoyl)-N-[(4-fluorophenyl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C23 H30 F N3 O4 |
| Smiles: | CCOC(c1c(C)c(C(CN(Cc2ccc(cc2)F)C(NC(C)(C)C)=O)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7945 |
| logD: | 3.7945 |
| logSw: | -4.1917 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.398 |
| InChI Key: | WTXDOVDUPFRHAY-UHFFFAOYSA-N |