2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(methanesulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(methanesulfonyl)amino]benzoic acid
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(methanesulfonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | F290-0258 |
| Compound Name: | 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-[(methanesulfonyl)amino]benzoic acid |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1ccc(cc1C(O)=O)NS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6877 |
| logD: | 1.572 |
| logSw: | -3.8276 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.625 |
| InChI Key: | RIGKQIJNPHQOTA-UHFFFAOYSA-N |