Chemical ID: 6560921

CSc1ccccc1NC(=O)CSc2ccccc2
Chemical ID:
6560921
Name [?]:
N-(2-methylsulfanylphenyl)-2-phenylsulfanyl-acetamide
SMILES [?]:
CSc1ccccc1NC(=O)CSc2ccccc2
InChi [?]:
InChI=1/C15H15NOS2/c1-18-14-10-6-5-9-13(14)16-15(17)11-19-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,17,16,18,6,5,15,19,7,4,12,14,8,3,10,9,11,2,13/E:(3,4)(7,8)/rA:19nCSCCCCCCNCOCSCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NOS2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.59654
Area:489.783
Solvation:-2.64804
Coulombic:-23.4848
Bond Count [?]
All:20
Single:13
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:289.418
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.98
LogP (Chemaxon):4.12

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Descriptor Annotations

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