Chemical ID: 6676176

c1cc(ccc1NC=Nc2ccc(cc2)Br)Br
Chemical ID:
6676176
Name [?]:
4-bromo-N-[(4-bromophenyl)iminomethyl]aniline
SMILES [?]:
c1cc(ccc1NC=Nc2ccc(cc2)Br)Br
InChi [?]:
InChI=1/C13H10Br2N2/c14-10-1-5-12(6-2-10)16-9-17-13-7-3-11(15)4-8-13/h1-9H,(H,16,17)
InChi Info:
AuxInfo=1/1/N:2,4,12,14,1,5,11,15,8,3,13,6,10,17,16,7,9/E:(1,2,3,4)(5,6,7,8)(10,11)(12,13)(14,15)(16,17)/rA:17nCCCCCCNCNCCCCCCBrBr/rB:s1;d2;s3;d4;d1s5;s6;s7;w8;s9;s10;d11;s12;d13;d10s14;s13;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10Br2N2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.74543
Area:447.0
Solvation:-1.42958
Coulombic:-18.1588
Bond Count [?]
All:18
Single:11
Double:7
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:354.04
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.56
LogP (Chemaxon):5.38

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