2-[(cyclopropanecarbonyl)amino]-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
2-[(cyclopropanecarbonyl)amino]-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
2-[(cyclopropanecarbonyl)amino]-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | F687-0851 |
| Compound Name: | 2-[(cyclopropanecarbonyl)amino]-5-{4-[2-(4-methylanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C24 H28 N4 O4 |
| Smiles: | Cc1ccc(cc1)NC(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(C1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.618 |
| logD: | -0.085 |
| logSw: | -3.6046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.705 |
| InChI Key: | ONMLMZQCPZLUPA-UHFFFAOYSA-N |