2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0329 |
| Compound Name: | 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 551.54 |
| Molecular Formula: | C23 H23 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccccc1N1CCN(CC1)c1ccc(cc1C(O)=O)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4023 |
| logD: | 2.1517 |
| logSw: | -4.1519 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.497 |
| InChI Key: | WXBPWEYWFYHKDB-UHFFFAOYSA-N |