N-(4-bromo-3-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
N-(4-bromo-3-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Compound characteristics
| Compound ID: | C791-0728 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea |
| Molecular Weight: | 496.42 |
| Molecular Formula: | C24 H22 Br N3 O2 S |
| Smiles: | Cc1ccc(CN2C(CSc3ccc(cc23)NC(Nc2ccc(c(C)c2)[Br])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.6118 |
| logD: | 6.6118 |
| logSw: | -5.4912 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.922 |
| InChI Key: | IOARUKVXYCBKQU-UHFFFAOYSA-N |