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Chemical ID: 7522188
Chemical ID:
7522188
Name [?]:
2-bromo-N-(5-chloro-2-phenoxy-phenyl)-benzamide
SMILES [?]:
c1ccc(cc1)Oc2ccc(cc2NC(=O)c3ccccc3Br)Cl
InChi [?]:
InChI=1/C19H13BrClNO2/c20-16-9-5-4-8-15(16)19(23)22-17-12-13(21)10-11-18(17)24-14-6-2-1-3-7-14/h1-12H,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,19,20,3,5,18,21,10,9,12,11,4,17,22,13,8,15,23,24,14,16,7/E:(2,3)(6,7)/rA:24nCCCCCCOCCCCCCNCOCCCCCCBrCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s13;s14;d15;s15;s17;d18;s19;d20;d17s21;s22;s11;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H13BrClNO2 |
All Atoms: | 37 |
Heavy Atoms: | 24 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.273 |
Area: | 543.529 |
Solvation: | -2.31523 |
Coulombic: | -32.7252 |
Bond Count [?]
All: | 26 |
Single: | 16 |
Double: | 10 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.89 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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