1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Chemical Structure Depiction of
1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Compound characteristics
Compound ID: | E647-0303 |
Compound Name: | 1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
Molecular Weight: | 315.41 |
Molecular Formula: | C18 H25 N3 O2 |
Smiles: | CCN1CCN(CC1)C(CN1C(CCCc2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6822 |
logD: | 1.506 |
logSw: | -2.0592 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 35.879 |
InChI Key: | AOKNXVFUNQINGN-UHFFFAOYSA-N |