Chemical ID: 5590281

c1ccc(c(c1)C=NNC(=O)c2ccccc2NC(=O)c3ccc(cc3)Cl)O
Chemical ID:
5590281
Name [?]:
2-(4-chlorobenzoyl)amino-N-[(2-hydroxyphenyl)methyleneamino]benzamide
SMILES [?]:
c1ccc(c(c1)C=NNC(=O)c2ccccc2NC(=O)c3ccc(cc3)Cl)O
InChi [?]:
InChI=1/C21H16ClN3O3/c22-16-11-9-14(10-12-16)20(27)24-18-7-3-2-6-17(18)21(28)25-23-13-15-5-1-4-8-19(15)26/h1-13,26H,(H,24,27)(H,25,28)
InChi Info:
AuxInfo=1/1/N:1,14,15,2,6,13,16,3,22,26,23,25,7,21,5,24,12,17,4,19,10,27,8,18,9,28,20,11/E:(9,10)(11,12)/rA:28nCCCCCCCNNCOCCCCCCNCOCCCCCCClO/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;d19;s19;s21;d22;s23;d24;d21s25;s24;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H16ClN3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.9617
Area:605.862
Solvation:-4.18481
Coulombic:-59.6271
Bond Count [?]
All:30
Single:18
Double:12
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:393.823
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:5.19
LogP (Chemaxon):5.18

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