N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | K788-8644 |
| Compound Name: | N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-({4-[(2-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 606.76 |
| Molecular Formula: | C36 H35 F N4 O2 S |
| Smiles: | C(CN1CCN(CC1)Cc1ccccc1)NC(c1ccc(/C=C2/C(N(Cc3ccccc3F)c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.766 |
| logD: | 5.6275 |
| logSw: | -5.9245 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.847 |
| InChI Key: | KOZHGNCQZYJFMN-UHFFFAOYSA-N |