Chemical ID: 4285433

c1ccnc(c1)CNC(=O)COc2ccc(cc2Cl)Cl
Chemical ID:
4285433
Name [?]:
2-(2,4-dichlorophenoxy)-N-(2-pyridylmethyl)acetamide
SMILES [?]:
c1ccnc(c1)CNC(=O)COc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C14H12Cl2N2O2/c15-10-4-5-13(12(16)7-10)20-9-14(19)18-8-11-3-1-2-6-17-11/h1-7H,8-9H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,15,14,3,17,7,11,16,5,18,13,9,20,19,4,8,10,12/rA:20nCCCNCCCNCOCOCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s18;s16;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12Cl2N2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.19075
Area:517.931
Solvation:-4.75753
Coulombic:-33.6576
Bond Count [?]
All:21
Single:14
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:311.163
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.9
LogP (Chemaxon):2.37

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Descriptor Annotations

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