Chemical ID: 4646778

Cc1ccc(cc1Cl)C(=O)NN=C2c3cc(cc(c3NC2=O)Br)Br
Chemical ID:
4646778
Name [?]:
3-chloro-N-(5,7-dibromo-2-oxo-indolin-3-ylidene)amino-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1Cl)C(=O)NN=C2c3cc(cc(c3NC2=O)Br)Br
InChi [?]:
InChI=1/C16H10Br2ClN3O2/c1-7-2-3-8(4-12(7)19)15(23)22-21-14-10-5-9(17)6-11(18)13(10)20-16(14)24/h2-6H,1H3,(H,22,23)(H,20,21,24)
InChi Info:
AuxInfo=1/1/N:1,3,4,6,15,17,2,5,16,14,18,7,19,13,9,21,24,23,8,20,12,11,10,22/rA:24nCCCCCCCClCONNCCCCCCCNCOBrBr/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;d9;s9;s11;w12;s13;s14;d15;s16;d17;d14s18;s19;s13s20;d21;s18;s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H10Br2ClN3O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.71515
Area:543.631
Solvation:-3.87563
Coulombic:-41.4451
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:471.53
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.31
LogP (Chemaxon):4.55

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