Chemical ID: 6318580

CCOc1cc(ccc1O)C=NNC(=O)C(C)Oc2ccc(cc2Cl)Cl
Chemical ID:
6318580
Name [?]:
2-(2,4-dichlorophenoxy)-N-[(3-ethoxy-4-hydroxy-phenyl)methyleneamino]propanamide
SMILES [?]:
CCOc1cc(ccc1O)C=NNC(=O)C(C)Oc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C18H18Cl2N2O4/c1-3-25-17-8-12(4-6-15(17)23)10-21-22-18(24)11(2)26-16-7-5-13(19)9-14(16)20/h4-11,23H,3H2,1-2H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,17,2,7,21,8,20,5,23,11,16,6,22,24,9,19,4,14,26,25,12,13,10,15,3,18/rA:26cCCOCCCCCCOCNNCOCCOCCCCCCClCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s6;w11;s12;s13;d14;s14;s16;s16;s18;s19;d20;s21;d22;d19s23;s24;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18Cl2N2O4
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:7.47724
Area:612.898
Solvation:-7.84521
Coulombic:-49.2243
Bond Count [?]
All:27
Single:19
Double:8
Rotors:8
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:397.252
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.38
LogP (Chemaxon):4.4

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