Chemical ID: 6990715

Cc1ccc(cc1Br)C(=O)Nc2ccccc2Br
Chemical ID:
6990715
Name [?]:
3-bromo-N-(2-bromophenyl)-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1Br)C(=O)Nc2ccccc2Br
InChi [?]:
InChI=1/C14H11Br2NO/c1-9-6-7-10(8-12(9)16)14(18)17-13-5-3-2-4-11(13)15/h2-8H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,13,3,4,6,2,5,17,7,12,9,18,8,11,10/rA:18nCCCCCCCBrCONCCCCCCBr/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11Br2NO
All Atoms:29
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.8682
Area:451.303
Solvation:-1.41438
Coulombic:-23.7823
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:369.051
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.81
LogP (Chemaxon):4.5

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Descriptor Annotations

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