N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Chemical Structure Depiction of
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide
Compound characteristics
Compound ID: | E015-1782 |
Compound Name: | N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxobutanamide |
Molecular Weight: | 442.6 |
Molecular Formula: | C25 H38 N4 O3 |
Smiles: | C1CCC(CC1)N1CCN(CCCNC(CCC(N2CCOc3ccccc23)=O)=O)CC1 |
Stereo: | ACHIRAL |
logP: | 1.8505 |
logD: | 0.9401 |
logSw: | -2.1857 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.364 |
InChI Key: | UVEIRAULLMFKCL-UHFFFAOYSA-N |