methyl 3,5-dimethyl-4-[N-methyl-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3,5-dimethyl-4-[N-methyl-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
methyl 3,5-dimethyl-4-[N-methyl-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-9841 |
| Compound Name: | methyl 3,5-dimethyl-4-[N-methyl-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C17 H20 N2 O4 S |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(C)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2326 |
| logD: | 2.2326 |
| logSw: | -2.6784 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.472 |
| InChI Key: | DBIKWQUBYBKHPV-NSHDSACASA-N |