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Chemical ID: 3965451
Chemical ID:
3965451
Name [?]:
N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide
SMILES [?]:
CCCCCC=CCC=CCC=CCC=CCCCCCC(=O)NCCO
InChi [?]:
InChI=1/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,25,26,22,24,27,23/rA:27nCCCCCCCCCCCCCCCCCCCCCCONCCO/rB:s1;s2;s3;s4;s5;w6;s7;s8;w9;s10;s11;w12;s13;s14;w15;s16;s17;s18;s19;s20;s21;d22;s22;s24;s25;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H41NO2 |
All Atoms: | 27 |
Heavy Atoms: | 27 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 15.6741 |
Area: | 760.3 |
Solvation: | -3.33337 |
Coulombic: | -43.9637 |
Bond Count [?]
All: | 26 |
Single: | 21 |
Double: | 5 |
Rotors: | 19 |
Chiral: | 4 |
Rigid Segments: | 11 |
Chemical Properties
Molecular Weight: | 375.588 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 6.46 |
LogP (Chemaxon): | 5.89 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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