N-(3-bromophenyl)-N'-(2-cyano-3-ethyl-3-methyl-3,4-dihydronaphthalen-1-yl)urea
Chemical Structure Depiction of
N-(3-bromophenyl)-N'-(2-cyano-3-ethyl-3-methyl-3,4-dihydronaphthalen-1-yl)urea
N-(3-bromophenyl)-N'-(2-cyano-3-ethyl-3-methyl-3,4-dihydronaphthalen-1-yl)urea
Compound characteristics
| Compound ID: | D469-0108 |
| Compound Name: | N-(3-bromophenyl)-N'-(2-cyano-3-ethyl-3-methyl-3,4-dihydronaphthalen-1-yl)urea |
| Molecular Weight: | 410.31 |
| Molecular Formula: | C21 H20 Br N3 O |
| Smiles: | CCC1(C)Cc2ccccc2C(=C1C#N)NC(Nc1cccc(c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6892 |
| logD: | 5.2201 |
| logSw: | -5.4613 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.717 |
| InChI Key: | PEDHMXKBDHIJOK-NRFANRHFSA-N |