N-[1-(4-butoxyphenyl)ethyl]-4-({4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Chemical Structure Depiction of
N-[1-(4-butoxyphenyl)ethyl]-4-({4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
N-[1-(4-butoxyphenyl)ethyl]-4-({4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide
Compound characteristics
| Compound ID: | C308-0677 |
| Compound Name: | N-[1-(4-butoxyphenyl)ethyl]-4-({4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)benzamide |
| Molecular Weight: | 580.72 |
| Molecular Formula: | C35 H33 F N2 O3 S |
| Smiles: | CCCCOc1ccc(cc1)C(C)NC(c1ccc(/C=C2/C(N(Cc3ccc(cc3)F)c3ccccc3S2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.8584 |
| logD: | 7.8584 |
| logSw: | -5.7257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.064 |
| InChI Key: | NQFVELLSVYPSBV-DEOSSOPVSA-N |