N-(4-bromo-3-methylphenyl)-N'-(7-hydroxy-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)urea
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-N'-(7-hydroxy-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)urea
N-(4-bromo-3-methylphenyl)-N'-(7-hydroxy-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)urea
Compound characteristics
| Compound ID: | G409-0145 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-N'-(7-hydroxy-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)urea |
| Molecular Weight: | 405.25 |
| Molecular Formula: | C16 H17 Br N6 O2 |
| Smiles: | CCCc1c(c(n2c(ncn2)n1)O)NC(Nc1ccc(c(C)c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0315 |
| logD: | 0.9134 |
| logSw: | -2.8858 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.345 |
| InChI Key: | FRWQQAFLIQDWEI-UHFFFAOYSA-N |