N-(4-bromophenyl)-N'-(2-cyano-3,3-diethyl-3,4-dihydronaphthalen-1-yl)urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-(2-cyano-3,3-diethyl-3,4-dihydronaphthalen-1-yl)urea
N-(4-bromophenyl)-N'-(2-cyano-3,3-diethyl-3,4-dihydronaphthalen-1-yl)urea
Compound characteristics
Compound ID: | D469-0054 |
Compound Name: | N-(4-bromophenyl)-N'-(2-cyano-3,3-diethyl-3,4-dihydronaphthalen-1-yl)urea |
Molecular Weight: | 424.34 |
Molecular Formula: | C22 H22 Br N3 O |
Smiles: | CCC1(CC)Cc2ccccc2C(=C1C#N)NC(Nc1ccc(cc1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 6.0903 |
logD: | 6.0027 |
logSw: | -5.5634 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.717 |
InChI Key: | UDFUWNUZBMSZJK-UHFFFAOYSA-N |