ChemDB: Chemical Search
Download
Chemical ID: 7667065
Chemical ID:
7667065
Name [?]:
None
SMILES [?]:
CCN(CC)C(=O)C1CCCN(C1)C(=O)Nc2cccc(c2)C(F)(F)F
InChi [?]:
InChI=1/C18H24F3N3O2/c1-3-23(4-2)16(25)13-7-6-10-24(12-13)17(26)22-15-9-5-8-14(11-15)18(19,20)21/h5,8-9,11,13H,3-4,6-7,10,12H2,1-2H3,(H,22,26)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,19,10,9,20,18,11,22,13,8,21,17,6,14,23,24,25,26,16,3,12,7,15/E:(1,2)(3,4)(19,20,21)/rA:26cCCNCCCOCCCCNCCONCCCCCCCFFF/rB:s1;s2;s3;s4;s3;d6;s6;s8;s9;s10;s11;s8s12;s12;d14;s14;s16;s17;d18;s19;d20;d17s21;s21;s23;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H24F3N3O2 |
All Atoms: | 50 |
Heavy Atoms: | 26 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.3765 |
Area: | 554.025 |
Solvation: | -3.47417 |
Coulombic: | -64.7497 |
Bond Count [?]
All: | 27 |
Single: | 22 |
Double: | 5 |
Rotors: | 8 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.68 |
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 |
---|