N-(3,4-dimethoxyphenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(3,4-dimethoxyphenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | L282-0537 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-N'-{4-[(5-methyl-6-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C24 H26 N6 O3 S |
| Smiles: | CCCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NC(Nc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.113 |
| logD: | 5.1129 |
| logSw: | -5.0015 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.859 |
| InChI Key: | PDOOFQTVBUWUMR-UHFFFAOYSA-N |