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Chemical ID: 6383710
Chemical ID:
6383710
Name [?]:
5-chloro-2-hydroxy-N-(1-naphthylmethyleneamino)benzamide
SMILES [?]:
c1ccc2c(c1)cccc2C=NNC(=O)c3cc(ccc3O)Cl
InChi [?]:
InChI=1/C18H13ClN2O2/c19-14-8-9-17(22)16(10-14)18(23)21-20-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-11,22H,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,2,8,6,7,9,3,19,20,17,11,5,10,18,4,16,21,14,23,12,13,22,15/rA:23nCCCCCCCCCCCNNCOCCCCCCOCl/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;w11;s12;s13;d14;s14;s16;d17;s18;d19;d16s20;s21;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H13ClN2O2 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.36052 |
Area: | 508.02 |
Solvation: | -4.33996 |
Coulombic: | -36.59 |
Bond Count [?]
All: | 25 |
Single: | 15 |
Double: | 10 |
Rotors: | 4 |
Chiral: | 1 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 324.761 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 5.9 |
LogP (Chemaxon): | 5.13 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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