2-(4-fluorobenzamido)-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
2-(4-fluorobenzamido)-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
2-(4-fluorobenzamido)-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | F687-0201 |
| Compound Name: | 2-(4-fluorobenzamido)-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid |
| Molecular Weight: | 490.53 |
| Molecular Formula: | C27 H27 F N4 O4 |
| Smiles: | Cc1ccc(cc1)NC(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3639 |
| logD: | 0.2476 |
| logSw: | -4.1377 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.182 |
| InChI Key: | RUWYUZKVISYLMO-UHFFFAOYSA-N |