methyl 4-{N-cyclohexyl-N-[(propan-2-yl)carbamoyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-cyclohexyl-N-[(propan-2-yl)carbamoyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-cyclohexyl-N-[(propan-2-yl)carbamoyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-4307 |
| Compound Name: | methyl 4-{N-cyclohexyl-N-[(propan-2-yl)carbamoyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 391.51 |
| Molecular Formula: | C21 H33 N3 O4 |
| Smiles: | CC(C)NC(N(C1CCCCC1)C(C)C(c1c(C)c(C(=O)OC)[nH]c1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7303 |
| logD: | 3.7303 |
| logSw: | -4.077 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.177 |
| InChI Key: | FAYAWYHCIIMSEN-HNNXBMFYSA-N |