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Chemical ID: 7509813
Chemical ID:
7509813
Name [?]:
5-(3,4-dichlorobenzoyl)aminobenzene-1,3-dicarboxamide
SMILES [?]:
c1cc(c(cc1C(=O)Nc2cc(cc(c2)C(=O)N)C(=O)N)Cl)Cl
InChi [?]:
InChI=1/C15H11Cl2N3O3/c16-11-2-1-7(6-12(11)17)15(23)20-10-4-8(13(18)21)3-9(5-10)14(19)22/h1-6H,(H2,18,21)(H2,19,22)(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,2,13,11,15,5,6,12,14,10,3,4,19,16,7,23,22,21,18,9,20,17,8/E:(4,5)(8,9)(13,14)(18,19)(21,22)/gE:(1,2)/rA:23nCCCCCCCONCCCCCCCONCONClCl/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;d16;s16;s12;d19;s19;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H11Cl2N3O3 |
All Atoms: | 34 |
Heavy Atoms: | 23 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.4549 |
Area: | 547.888 |
Solvation: | -4.2423 |
Coulombic: | -72.5061 |
Bond Count [?]
All: | 24 |
Single: | 15 |
Double: | 9 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.01 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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