2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-0484 |
| Compound Name: | 2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-5-[(thiophene-2-carbonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 549.57 |
| Molecular Formula: | C24 H25 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)c1ccc(cc1C(O)=O)NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0656 |
| logD: | 2.8149 |
| logSw: | -4.3887 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.386 |
| InChI Key: | QTWGKXCPDZSHOJ-KRWDZBQOSA-N |