2-benzylidene-6-(4-ethylpiperazine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-benzylidene-6-(4-ethylpiperazine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-benzylidene-6-(4-ethylpiperazine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0828 |
| Compound Name: | 2-benzylidene-6-(4-ethylpiperazine-1-carbonyl)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 497.66 |
| Molecular Formula: | C30 H31 N3 O2 S |
| Smiles: | CCN1CCN(CC1)C(c1ccc2c(c1)N(Cc1cccc(C)c1)C(/C(=C\c1ccccc1)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3841 |
| logD: | 5.2079 |
| logSw: | -5.3192 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.255 |
| InChI Key: | MWAUKPHIWWFUTQ-UHFFFAOYSA-N |