N-(2-bromophenyl)-N'-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]urea
Chemical Structure Depiction of
N-(2-bromophenyl)-N'-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]urea
N-(2-bromophenyl)-N'-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]urea
Compound characteristics
| Compound ID: | SA55-0542 |
| Compound Name: | N-(2-bromophenyl)-N'-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]urea |
| Molecular Weight: | 379.25 |
| Molecular Formula: | C16 H19 Br N4 O2 |
| Smiles: | Cn1c2CCOCc2c(CCNC(Nc2ccccc2[Br])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.4967 |
| logD: | 1.4967 |
| logSw: | -2.0341 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.847 |
| InChI Key: | PQQXFRISKYZWJZ-UHFFFAOYSA-N |