methyl 3,5-dimethyl-4-[N-(prop-2-en-1-yl)-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3,5-dimethyl-4-[N-(prop-2-en-1-yl)-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
methyl 3,5-dimethyl-4-[N-(prop-2-en-1-yl)-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-8073 |
| Compound Name: | methyl 3,5-dimethyl-4-[N-(prop-2-en-1-yl)-N-(thiophene-2-carbonyl)alanyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C19 H22 N2 O4 S |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(CC=C)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0942 |
| logD: | 3.0942 |
| logSw: | -3.2405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.704 |
| InChI Key: | GENBGDRYAVKIQN-ZDUSSCGKSA-N |