ethyl 4-[(4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methylpiperazine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methylpiperazine-1-carbonyl)amino]benzoate
ethyl 4-[(4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methylpiperazine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | V006-8824 |
| Compound Name: | ethyl 4-[(4-{6-[(2-fluorophenyl)methyl]-6H-thieno[2,3-b]pyrrole-5-carbonyl}-2-methylpiperazine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 548.64 |
| Molecular Formula: | C29 H29 F N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCN(CC1C)C(c1cc2ccsc2n1Cc1ccccc1F)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8236 |
| logD: | 5.8236 |
| logSw: | -5.7357 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.443 |
| InChI Key: | JFTVGADIOGQBLM-IBGZPJMESA-N |