Molecule

ID:76857

General Information
Structure
MolImage
Molecular Formula
C₁₈H₂₅N
Molecular Mass
255.3978
Exact Mass
255.19869981
Charge
0
InChI
InChI=1S/C18H25N/c1-4-10-18-16(6-3)13-15(5-2)14-19(18)17-11-8-7-9-12-17/h7-9,11-14,18H,4-6,10H2,1-3H3
InChIKey
IAAASXBHFUJLHW-UHFFFAOYSA-N
Canonic Smiles
CCCC1C(=CC(=CN1c1ccccc1)CC)CC
Isomeric Smiles
N1(c2ccccc2)C=C(CC)C=C(C1CCC)CC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.4964185
LogD (pH = 7.4)
5.4971375
Log P
5.4971466
Molar Refractivity
84.9941
Polarizability
32.450737
Polar Surface Area
3.24
Rotatable Bonds
5
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation
CAS 34562-31-2|CAS 34562-31-7|3,5-Diethyl-1,2-dihydro-1-phenyl-2-propylpyridine|3,5-diethyl-1-phenyl-2-propyl-2H-pyridine|3,5-diethyl-1-phenyl-2-propyl-1,2-dihydropyridine|PDHP|3,5-二乙基-1,2-二氢-1-... | Molfinder