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Chemical ID: 4290426
Chemical ID:
4290426
Name [?]:
2-chloro-5-(2-chlorobenzoyl)amino-benzamide
SMILES [?]:
c1ccc(c(c1)C(=O)Nc2ccc(c(c2)C(=O)N)Cl)Cl
InChi [?]:
InChI=1/C14H10Cl2N2O2/c15-11-4-2-1-3-9(11)14(20)18-8-5-6-12(16)10(7-8)13(17)19/h1-7H,(H2,17,19)(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,11,12,15,10,5,14,4,13,16,7,20,19,18,9,17,8/rA:20nCCCCCCCONCCCCCCCONClCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;d16;s16;s13;s4;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H10Cl2N2O2 |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.5784 |
Area: | 477.664 |
Solvation: | -3.36321 |
Coulombic: | -47.5035 |
Bond Count [?]
All: | 21 |
Single: | 13 |
Double: | 8 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 309.147 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 4 |
XLogP: | 3.12 |
LogP (Chemaxon): | 2.79 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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