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Chemical ID: 6372264
Chemical ID:
6372264
Name [?]:
4-methyl-N-[8-(4-methylbenzoyl)aminooctyl]benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)NCCCCCCCCNC(=O)c2ccc(cc2)C
InChi [?]:
InChI=1/C24H32N2O2/c1-19-9-13-21(14-10-19)23(27)25-17-7-5-3-4-6-8-18-26-24(28)22-15-11-20(2)12-16-22/h9-16H,3-8,17-18H2,1-2H3,(H,25,27)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,28,14,15,13,16,12,17,3,7,24,26,4,6,23,27,11,18,2,25,5,22,8,20,10,19,9,21/E:(1,2)(3,4)(5,6)(7,8)(9,10,11,12)(13,14,15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)/gE:(1,2)/rA:28nCCCCCCCCONCCCCCCCCNCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;s11;s12;s13;s14;s15;s16;s17;s18;s19;d20;s20;s22;d23;s24;d25;d22s26;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H32N2O2 |
All Atoms: | 28 |
Heavy Atoms: | 28 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 14.6693 |
Area: | 700.604 |
Solvation: | -2.84584 |
Coulombic: | -47.475 |
Bond Count [?]
All: | 29 |
Single: | 21 |
Double: | 8 |
Rotors: | 13 |
Chiral: | 0 |
Rigid Segments: | 9 |
Chemical Properties
Molecular Weight: | 380.523 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 6.09 |
LogP (Chemaxon): | 4.73 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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