2-(3-methylbutanamido)-5-(4-methylpiperazin-1-yl)benzoic acid
Chemical Structure Depiction of
2-(3-methylbutanamido)-5-(4-methylpiperazin-1-yl)benzoic acid
2-(3-methylbutanamido)-5-(4-methylpiperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F687-0472 |
| Compound Name: | 2-(3-methylbutanamido)-5-(4-methylpiperazin-1-yl)benzoic acid |
| Molecular Weight: | 319.4 |
| Molecular Formula: | C17 H25 N3 O3 |
| Smiles: | CC(C)CC(Nc1ccc(cc1C(O)=O)N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9513 |
| logD: | 1.9513 |
| logSw: | -2.8077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.027 |
| InChI Key: | MXUYLDOYMVAKDY-UHFFFAOYSA-N |