N-(2-methoxy-5-methylphenyl)-N'-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}urea
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-N'-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}urea
N-(2-methoxy-5-methylphenyl)-N'-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}urea
Compound characteristics
| Compound ID: | F524-0086 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-N'-{[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}urea |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C22 H21 N5 O3 S |
| Smiles: | Cc1ccc(c(c1)NC(NCC1=CC(N2C(=N1)SC(c1ccccc1C)=N2)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0724 |
| logD: | 3.0719 |
| logSw: | -3.4568 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.828 |
| InChI Key: | BMGCFLWJJSXXGU-UHFFFAOYSA-N |