Chemical ID: 4274246

CC(=O)Nc1ccc(c(c1)Cl)NC(=O)c2ccc(cc2)C(=O)Nc3ccc(cc3Cl)NC(=O)C
Chemical ID:
4274246
Name [?]:
N,N'-bis(4-acetamido-2-chloro-phenyl)terephthalamide
SMILES [?]:
CC(=O)Nc1ccc(c(c1)Cl)NC(=O)c2ccc(cc2)C(=O)Nc3ccc(cc3Cl)NC(=O)C
InChi [?]:
InChI=1/C24H20Cl2N4O4/c1-13(31)27-17-7-9-21(19(25)11-17)29-23(33)15-3-5-16(6-4-15)24(34)30-22-10-8-18(12-20(22)26)28-14(2)32/h3-12H,1-2H3,(H,27,31)(H,28,32)(H,29,33)(H,30,34)
InChi Info:
AuxInfo=1/1/N:1,34,16,20,17,19,6,26,7,25,10,28,2,32,15,18,5,27,9,29,8,24,13,21,11,30,4,31,12,23,3,33,14,22/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)(29,30)(31,32)(33,34)/gE:(1,2)(3,4)/rA:34nCCONCCCCCCClNCOCCCCCCCONCCCCCCClNCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;s8;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;d21;s21;s23;s24;d25;s26;d27;d24s28;s29;s27;s31;d32;s32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20Cl2N4O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.4505
Area:744.412
Solvation:-5.15984
Coulombic:-81.6564
Bond Count [?]
All:36
Single:23
Double:13
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:499.346
H-Bond Donors:4
H-Bond Acceptors:8
XLogP:2.87
LogP (Chemaxon):2.55

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