4-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl}-6-(2-methylbutan-2-yl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl}-6-(2-methylbutan-2-yl)-2H-1,4-benzoxazin-3(4H)-one
4-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl}-6-(2-methylbutan-2-yl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | V014-6948 |
| Compound Name: | 4-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-oxobutyl}-6-(2-methylbutan-2-yl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 493.65 |
| Molecular Formula: | C29 H39 N3 O4 |
| Salt: | not_available |
| Smiles: | CCC(C)(C)c1ccc2c(c1)N(CCCC(N1CCN(CC1)c1ccccc1OCC)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2999 |
| logD: | 4.2995 |
| logSw: | -4.264 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.609 |
| InChI Key: | PSPJHVYQCCZYLE-UHFFFAOYSA-N |