N,N-dibutyl-N'-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)urea
Chemical Structure Depiction of
N,N-dibutyl-N'-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)urea
N,N-dibutyl-N'-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)urea
Compound characteristics
| Compound ID: | D469-0021 |
| Compound Name: | N,N-dibutyl-N'-(2-cyano-3,3-dimethyl-3,4-dihydronaphthalen-1-yl)urea |
| Molecular Weight: | 353.51 |
| Molecular Formula: | C22 H31 N3 O |
| Smiles: | CCCCN(CCCC)C(NC1=C(C#N)C(C)(C)Cc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6571 |
| logD: | 5.6196 |
| logSw: | -5.3967 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.674 |
| InChI Key: | ISASBHRSAJDBPO-UHFFFAOYSA-N |