N-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)-N'-(2-methoxyphenyl)urea
Chemical Structure Depiction of
N-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)-N'-(2-methoxyphenyl)urea
N-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)-N'-(2-methoxyphenyl)urea
Compound characteristics
Compound ID: | D469-0055 |
Compound Name: | N-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)-N'-(2-methoxyphenyl)urea |
Molecular Weight: | 347.42 |
Molecular Formula: | C21 H21 N3 O2 |
Smiles: | CC1(C)Cc2ccccc2C(=C1C#N)NC(Nc1ccccc1OC)=O |
Stereo: | ACHIRAL |
logP: | 4.4443 |
logD: | 4.421 |
logSw: | -4.5018 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.65 |
InChI Key: | RIMUFDPGZTVBLR-UHFFFAOYSA-N |