4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | K788-8947 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[2-(cyclohex-1-en-1-yl)ethyl]benzamide |
| Molecular Weight: | 529.1 |
| Molecular Formula: | C31 H29 Cl N2 O2 S |
| Smiles: | C1CCC(CCNC(c2ccc(\C=C3/C(N(Cc4cccc(c4)[Cl])c4ccccc4S3)=O)cc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 7.1012 |
| logD: | 7.1012 |
| logSw: | -6.4563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.516 |
| InChI Key: | LTLGTCRYQFSOFQ-UHFFFAOYSA-N |