4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(morpholin-4-yl)propyl]benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(morpholin-4-yl)propyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(morpholin-4-yl)propyl]benzamide
Compound characteristics
| Compound ID: | K788-8912 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[3-(morpholin-4-yl)propyl]benzamide |
| Molecular Weight: | 548.1 |
| Molecular Formula: | C30 H30 Cl N3 O3 S |
| Smiles: | C(CNC(c1ccc(\C=C2/C(N(Cc3cccc(c3)[Cl])c3ccccc3S2)=O)cc1)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.9927 |
| logD: | 4.6045 |
| logSw: | -5.1353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.215 |
| InChI Key: | XPBBSNQUGOMBGS-UHFFFAOYSA-N |