Chemical ID: 7522188

c1ccc(cc1)Oc2ccc(cc2NC(=O)c3ccccc3Br)Cl
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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