ethyl {1-[({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
Chemical Structure Depiction of
ethyl {1-[({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
ethyl {1-[({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
Compound characteristics
| Compound ID: | G331-0392 |
| Compound Name: | ethyl {1-[({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C25 H35 N3 O3 |
| Smiles: | CCOC(CC1(CCCCC1)NC(NCc1cccn1Cc1cc(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9957 |
| logD: | 4.9957 |
| logSw: | -4.3724 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.457 |
| InChI Key: | MIRJGRRZWDHSSZ-UHFFFAOYSA-N |