N-{3-[benzyl(methyl)amino]propyl}-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
N-{3-[benzyl(methyl)amino]propyl}-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Compound characteristics
| Compound ID: | C791-0787 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C28 H32 N4 O2 S |
| Smiles: | Cc1ccc(CN2C(CSc3ccc(cc23)NC(NCCCN(C)Cc2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7869 |
| logD: | 3.5021 |
| logSw: | -4.4232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.18 |
| InChI Key: | QINAYEXVRSFIGD-UHFFFAOYSA-N |