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Chemical ID: 6435071
Chemical ID:
6435071
Name [?]:
N,N'-bis(4-methoxyphenyl)-N,N'-dimethyl-benzene-1,3-dicarboxamide
SMILES [?]:
CN(c1ccc(cc1)OC)C(=O)c2cccc(c2)C(=O)N(C)c3ccc(cc3)OC
InChi [?]:
InChI=1/C24H24N2O4/c1-25(19-8-12-21(29-3)13-9-19)23(27)17-6-5-7-18(16-17)24(28)26(2)20-10-14-22(30-4)15-11-20/h5-16H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,22,10,30,15,14,16,4,8,24,28,5,7,25,27,18,13,17,3,23,6,26,11,19,2,21,12,20,9,29/E:(1,2)(3,4)(6,7)(8,9,10,11)(12,13,14,15)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)/rA:30nCNCCCCCCOCCOCCCCCCCONCCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s2;d11;s11;s13;d14;s15;d16;d13s17;s17;d19;s19;s21;s21;s23;d24;s25;d26;d23s27;s26;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H24N2O4 |
All Atoms: | 30 |
Heavy Atoms: | 30 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.83916 |
Area: | 626.8 |
Solvation: | -5.83083 |
Coulombic: | -48.9128 |
Bond Count [?]
All: | 32 |
Single: | 21 |
Double: | 11 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 9 |
Chemical Properties
Molecular Weight: | 404.458 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 6 |
XLogP: | 4.08 |
LogP (Chemaxon): | 3.19 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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