methyl 4-[3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propanamido]benzoate
methyl 4-[3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | G354-0137 |
| Compound Name: | methyl 4-[3-(1H-pyrrol-1-yl)-3-(thiophen-2-yl)propanamido]benzoate |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C19 H18 N2 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(CC(c1cccs1)n1cccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7765 |
| logD: | 3.7755 |
| logSw: | -4.074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.831 |
| InChI Key: | KSSVFBWOZLFJNK-INIZCTEOSA-N |