Chemical ID: 7426147

c1ccc2cc(ccc2c1)SCC(=O)Nc3ccccc3Cl
Chemical ID:
7426147
Name [?]:
N-(2-chlorophenyl)-2-(2-naphthylsulfanyl)acetamide
SMILES [?]:
c1ccc2cc(ccc2c1)SCC(=O)Nc3ccccc3Cl
InChi [?]:
InChI=1/C18H14ClNOS/c19-16-7-3-4-8-17(16)20-18(21)12-22-15-10-9-13-5-1-2-6-14(13)11-15/h1-11H,12H2,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,19,18,10,3,20,17,8,7,5,12,9,4,6,21,16,13,22,15,14,11/rA:22nCCCCCCCCCCSCCONCCCCCCCl/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H14ClNOS
All Atoms:36
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.5657
Area:527.534
Solvation:-2.62268
Coulombic:-23.9557
Bond Count [?]
All:24
Single:15
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.829
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.12
LogP (Chemaxon):4.33

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Descriptor Annotations

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