Chemical ID: 7380449

c1cc(ccc1C(=O)NCCc2c[nH]c3c2cc(cc3)Cl)Cl
Chemical ID:
7380449
Name [?]:
4-chloro-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide
SMILES [?]:
c1cc(ccc1C(=O)NCCc2c[nH]c3c2cc(cc3)Cl)Cl
InChi [?]:
InChI=1/C17H14Cl2N2O/c18-13-3-1-11(2-4-13)17(22)20-8-7-12-10-21-16-6-5-14(19)9-15(12)16/h1-6,9-10,21H,7-8H2,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,19,20,11,10,17,13,6,12,3,18,16,15,7,22,21,9,14,8/E:(1,2)(3,4)/rA:22nCCCCCCCONCCCCNCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;s11;d12;s13;s14;s12s15;d16;s17;d18;d15s19;s18;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14Cl2N2O
All Atoms:36
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.4446
Area:550.24
Solvation:-2.31135
Coulombic:-34.9558
Bond Count [?]
All:24
Single:16
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:333.211
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.61
LogP (Chemaxon):4.41

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