methyl 3-({4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl}amino)thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-({4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl}amino)thiophene-2-carboxylate
methyl 3-({4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl}amino)thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y205-7810 |
| Compound Name: | methyl 3-({4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl}amino)thiophene-2-carboxylate |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C18 H20 F N3 O3 S |
| Smiles: | COC(c1c(ccs1)NC(N1CCN(CC1)Cc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7152 |
| logD: | 2.536 |
| logSw: | -3.0913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.742 |
| InChI Key: | SIMYYDDSXLVRKH-UHFFFAOYSA-N |