N-[(4-fluorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
N-[(4-fluorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0489 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 525.54 |
| Molecular Formula: | C18 H22 F N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1)S(CCN(Cc1ccc(cc1)F)C(c1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3226 |
| logD: | 0.9779 |
| logSw: | -2.2636 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.012 |
| InChI Key: | GSGCZPXRZBACQX-UHFFFAOYSA-N |