Chemical ID: 6620980

CCCCOc1ccc(cc1C=NNC(=O)c2cc(ccc2OC)Br)Br
Chemical ID:
6620980
Name [?]:
5-bromo-N-[(5-bromo-2-butoxy-phenyl)methyleneamino]-2-methoxy-benzamide
SMILES [?]:
CCCCOc1ccc(cc1C=NNC(=O)c2cc(ccc2OC)Br)Br
InChi [?]:
InChI=1/C19H20Br2N2O3/c1-3-4-9-26-17-7-5-14(20)10-13(17)12-22-23-19(24)16-11-15(21)6-8-18(16)25-2/h5-8,10-12H,3-4,9H2,1-2H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,24,2,3,8,20,7,21,4,10,18,12,11,9,19,17,6,22,15,26,25,13,14,16,23,5/rA:26nCCCCOCCCCCCCNNCOCCCCCCOCBrBr/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;w12;s13;s14;d15;s15;s17;d18;s19;d20;d17s21;s22;s23;s19;s9;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20Br2N2O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.21
Area:600.078
Solvation:-5.79196
Coulombic:-33.7128
Bond Count [?]
All:27
Single:19
Double:8
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:484.182
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:6.77
LogP (Chemaxon):5.53

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