N-[(4-ethoxyphenyl)methyl]-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
N-[(4-ethoxyphenyl)methyl]-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Compound characteristics
| Compound ID: | C791-0752 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C26 H27 N3 O3 S |
| Smiles: | CCOc1ccc(CNC(Nc2ccc3c(c2)N(Cc2ccc(C)cc2)C(CS3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0227 |
| logD: | 5.0227 |
| logSw: | -4.5227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.368 |
| InChI Key: | BJRBVHUBQDNNRF-UHFFFAOYSA-N |