ChemDB: Chemical Search
Download
Chemical ID: 7655192
Chemical ID:
7655192
Name [?]:
None
SMILES [?]:
CCC(=O)N(c1ccccc1)C2CCN(CC2)CCc3ccc(cc3)O
InChi [?]:
InChI=1/C22H28N2O2/c1-2-22(26)24(19-6-4-3-5-7-19)20-13-16-23(17-14-20)15-12-18-8-10-21(25)11-9-18/h3-11,20,25H,2,12-17H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,9,8,10,7,11,21,25,22,24,19,13,17,18,14,16,20,6,12,23,3,15,5,26,4/E:(4,5)(6,7)(8,9)(10,11)(13,14)(16,17)/rA:26nCCCONCCCCCCCCCNCCCCCCCCCCO/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s5;s12;s13;s14;s15;s12s16;s15;s18;s19;s20;d21;s22;d23;d20s24;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C22H28N2O2 |
All Atoms: | 54 |
Heavy Atoms: | 26 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.0763 |
Area: | 582.388 |
Solvation: | -3.48344 |
Coulombic: | -38.3991 |
Bond Count [?]
All: | 28 |
Single: | 21 |
Double: | 7 |
Rotors: | 7 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.53 |
LogP (Chemaxon): | None |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|