ethyl 3,5-dimethyl-4-{N-[(pyridin-2-yl)methyl]-N-(thiophene-2-carbonyl)alanyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-{N-[(pyridin-2-yl)methyl]-N-(thiophene-2-carbonyl)alanyl}-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-{N-[(pyridin-2-yl)methyl]-N-(thiophene-2-carbonyl)alanyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V027-8002 |
| Compound Name: | ethyl 3,5-dimethyl-4-{N-[(pyridin-2-yl)methyl]-N-(thiophene-2-carbonyl)alanyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(C(C)N(Cc2ccccn2)C(c2cccs2)=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2799 |
| logD: | 3.2799 |
| logSw: | -3.4575 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.577 |
| InChI Key: | GHGIQZNMGVDCIG-INIZCTEOSA-N |