N-(3-chloro-2-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
N-(3-chloro-2-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea
Compound characteristics
Compound ID: | C791-0719 |
Compound Name: | N-(3-chloro-2-methylphenyl)-N'-{4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl}urea |
Molecular Weight: | 451.97 |
Molecular Formula: | C24 H22 Cl N3 O2 S |
Smiles: | Cc1ccc(CN2C(CSc3ccc(cc23)NC(Nc2cccc(c2C)[Cl])=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 6.2455 |
logD: | 6.2452 |
logSw: | -6.0936 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 47.224 |
InChI Key: | VDJQLHNVZJOHSM-UHFFFAOYSA-N |