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Chemical ID: 6401169

Chemical ID:

6401169

Name [?]:

N-[(4-chlorophenyl)methyleneamino]-2-(2-naphthyloxy)acetamide

SMILES [?]:

c1ccc2cc(ccc2c1)OCC(=O)NN=Cc3ccc(cc3)Cl

InChi [?]:

InChI=1/C19H15ClN2O2/c20-17-8-5-14(6-9-17)12-21-22-19(23)13-24-18-10-7-15-3-1-2-4-16(15)11-18/h1-12H,13H2,(H,22,23)

InChi Info:

AuxInfo=1/1/N:1,2,10,3,19,23,8,20,22,7,5,17,12,18,9,4,21,6,13,24,16,15,14,11/E:(5,6)(8,9)/rA:24nCCCCCCCCCCOCCONNCCCCCCCCl/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;s12;d13;s13;s15;w16;s17;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₁₅ClN₂O₂
All Atoms:	24
Heavy Atoms:	24
Chiral Atoms:	0

ZAP Information [?]

Total:	8.41721
Area:	557.849
Solvation:	-5.52902
Coulombic:	-27.6724

Bond Count [?]

All:	26
Single:	16
Double:	10
Rotors:	6
Chiral:	1
Rigid Segments:	5

Chemical Properties

Molecular Weight:	338.787
H-Bond Donors:	1
H-Bond Acceptors:	4
XLogP:	5.56
LogP (Chemaxon):	4.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value