{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}[6-(2-methylpropanamido)-1H-indol-3-yl]acetic acid
Chemical Structure Depiction of
{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}[6-(2-methylpropanamido)-1H-indol-3-yl]acetic acid
{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}[6-(2-methylpropanamido)-1H-indol-3-yl]acetic acid
Compound characteristics
| Compound ID: | IB08-1254 |
| Compound Name: | {4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}[6-(2-methylpropanamido)-1H-indol-3-yl]acetic acid |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C25 H36 N6 O4 |
| Smiles: | CC(C)C(Nc1ccc2c(c[nH]c2c1)C(C(O)=O)N1CCN(CC1)CC(N1CCN(C)CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.46 |
| logD: | -3.1 |
| logSw: | -2.04 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 161.73 |
| InChI Key: | KRRDAVFDTWAJSE-HSZRJFAPSA-N |