Chemical ID: 3967805

c1cc(c(cc1N(=O)=O)Cl)NC(=O)c2cc(ccc2O)Cl
Chemical ID:
3967805
Name [?]:
5-chloro-N-(2-chloro-4-nitro-phenyl)-2-hydroxy-benzamide
SMILES [?]:
c1cc(c(cc1N(=O)=O)Cl)NC(=O)c2cc(ccc2O)Cl
InChi [?]:
InChI=1/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)
InChi Info:
AuxInfo=1/1/N:17,1,2,18,15,5,16,6,14,4,3,19,12,21,10,11,7,20,13,8,9/E:(20,21)/CRV:17.5/rA:21nCCCCCCNOOClNCOCCCCCCOCl/rB:s1;d2;s3;d4;d1s5;s6;d7;d7;s4;s3;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;s16;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H8Cl2N2O4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:4.05075
Area:501.8
Solvation:-8.49426
Coulombic:-47.8094
Bond Count [?]
All:22
Single:13
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.119
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.15
LogP (Chemaxon):3.16

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