N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | K788-9310 |
| Compound Name: | N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-({4-[(2-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 540.73 |
| Molecular Formula: | C32 H36 N4 O2 S |
| Smiles: | CCN1CCN(CCNC(c2ccc(\C=C3/C(N(Cc4ccccc4C)c4ccccc4S3)=O)cc2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.0908 |
| logD: | 4.2982 |
| logSw: | -4.7582 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.844 |
| InChI Key: | YOYUMQYGKMEWJR-UHFFFAOYSA-N |