Chemical ID: 4215915

COc1cccc(c1)C=NNC(=O)COc2cccc(c2)Cl
Chemical ID:
4215915
Name [?]:
2-(3-chlorophenoxy)-N-[(3-methoxyphenyl)methyleneamino]acetamide
SMILES [?]:
COc1cccc(c1)C=NNC(=O)COc2cccc(c2)Cl
InChi [?]:
InChI=1/C16H15ClN2O3/c1-21-14-6-2-4-12(8-14)10-18-19-16(20)11-22-15-7-3-5-13(17)9-15/h2-10H,11H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,5,18,6,19,4,17,8,21,9,14,7,20,3,16,12,22,10,11,13,2,15/rA:22nCOCCCCCCCNNCOCOCCCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;w9;s10;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15ClN2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:6.7756
Area:538.469
Solvation:-6.68611
Coulombic:-33.1571
Bond Count [?]
All:23
Single:15
Double:8
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:318.755
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.21
LogP (Chemaxon):3.28

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