N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(5-methylpyridin-2-yl)urea
Chemical Structure Depiction of
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(5-methylpyridin-2-yl)urea
N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(5-methylpyridin-2-yl)urea
Compound characteristics
Compound ID: | C791-0705 |
Compound Name: | N-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}-N'-(5-methylpyridin-2-yl)urea |
Molecular Weight: | 418.52 |
Molecular Formula: | C23 H22 N4 O2 S |
Smiles: | Cc1ccc(CN2C(CSc3ccc(cc23)NC(Nc2ccc(C)cn2)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.2996 |
logD: | 5.2939 |
logSw: | -5.0554 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.626 |
InChI Key: | IPBSDAJKRDQFKV-UHFFFAOYSA-N |