methyl 4-{[2-(4-ethylpiperazin-1-yl)-4-methylpyrimidine-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(4-ethylpiperazin-1-yl)-4-methylpyrimidine-5-carbonyl]amino}benzoate
methyl 4-{[2-(4-ethylpiperazin-1-yl)-4-methylpyrimidine-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G415-3628 |
| Compound Name: | methyl 4-{[2-(4-ethylpiperazin-1-yl)-4-methylpyrimidine-5-carbonyl]amino}benzoate |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C20 H25 N5 O3 |
| Smiles: | CCN1CCN(CC1)c1ncc(C(Nc2ccc(cc2)C(=O)OC)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1952 |
| logD: | 1.5056 |
| logSw: | -2.7868 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.089 |
| InChI Key: | HZVLEQQLLCSIMW-UHFFFAOYSA-N |