N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-[(4-propoxyphenyl)methyl]urea
Chemical Structure Depiction of
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-[(4-propoxyphenyl)methyl]urea
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-[(4-propoxyphenyl)methyl]urea
Compound characteristics
| Compound ID: | C791-0749 |
| Compound Name: | N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-[(4-propoxyphenyl)methyl]urea |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C27 H29 N3 O3 S |
| Smiles: | CCCOc1ccc(CNC(Nc2ccc3c(c2)N(Cc2ccc(C)cc2)C(CS3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6131 |
| logD: | 5.6131 |
| logSw: | -5.2905 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.662 |
| InChI Key: | ZJQXVAGFAVXRFE-UHFFFAOYSA-N |