6-[(2-ethylphenoxy)acetyl]-4-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[(2-ethylphenoxy)acetyl]-4-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-2H-1,4-benzoxazin-3(4H)-one
6-[(2-ethylphenoxy)acetyl]-4-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | V022-4560 |
| Compound Name: | 6-[(2-ethylphenoxy)acetyl]-4-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C27 H33 N3 O5 |
| Smiles: | CCc1ccccc1OCC(c1ccc2c(c1)N(CCCC(N1CCN(C)CC1)=O)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0944 |
| logD: | 1.8474 |
| logSw: | -2.7278 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.477 |
| InChI Key: | QEIOOUXARPAEAU-UHFFFAOYSA-N |