methyl 2-[2-{[(1,5-dimethyl-1H-pyrrol-2-yl)methyl]amino}(oxo)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-{[(1,5-dimethyl-1H-pyrrol-2-yl)methyl]amino}(oxo)acetamido]benzoate
methyl 2-[2-{[(1,5-dimethyl-1H-pyrrol-2-yl)methyl]amino}(oxo)acetamido]benzoate
Compound characteristics
| Compound ID: | 8018-3099 |
| Compound Name: | methyl 2-[2-{[(1,5-dimethyl-1H-pyrrol-2-yl)methyl]amino}(oxo)acetamido]benzoate |
| Molecular Weight: | 329.35 |
| Molecular Formula: | C17 H19 N3 O4 |
| Smiles: | Cc1ccc(CNC(C(Nc2ccccc2C(=O)OC)=O)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 1.5731 |
| logD: | -1.4035 |
| logSw: | -2.3694 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.228 |
| InChI Key: | YZKAYTSPZWNOEA-UHFFFAOYSA-N |