6-methyl-4-(4-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-4-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-methyl-4-(4-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-4-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one
6-methyl-4-(4-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-4-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F438-0432 |
| Compound Name: | 6-methyl-4-(4-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-4-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 460.58 |
| Molecular Formula: | C27 H32 N4 O3 |
| Smiles: | [H]c1ccc2c(c1)c(CN1CCN(CC1)C(CCCN1C(COc3ccc(C)cc13)=O)=O)c([H])n2C |
| Stereo: | ACHIRAL |
| logP: | 2.256 |
| logD: | 0.9395 |
| logSw: | -2.6533 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.539 |
| InChI Key: | PZYNOFTWEDFOIB-UHFFFAOYSA-N |