N-{1-[4-(2-ethylhexanoyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[4-(2-ethylhexanoyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-4-methylbenzamide
N-{1-[4-(2-ethylhexanoyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V009-5534 |
| Compound Name: | N-{1-[4-(2-ethylhexanoyl)-3-methylpiperazin-1-yl]-3-methyl-1-oxopentan-2-yl}-4-methylbenzamide |
| Molecular Weight: | 457.66 |
| Molecular Formula: | C27 H43 N3 O3 |
| Smiles: | CCCCC(CC)C(N1CCN(CC1C)C(C(C(C)CC)NC(c1ccc(C)cc1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1828 |
| logD: | 5.1828 |
| logSw: | -4.9086 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.87 |
| InChI Key: | KRPIVRHQTGNVPU-UHFFFAOYSA-N |