Chemical ID: 4230256

CSc1ccccc1NC(=O)Cc2ccccc2
Chemical ID:
4230256
Name [?]:
N-(2-methylsulfanylphenyl)-2-phenyl-acetamide
SMILES [?]:
CSc1ccccc1NC(=O)Cc2ccccc2
InChi [?]:
InChI=1/C15H15NOS/c1-18-14-10-6-5-9-13(14)16-15(17)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,6,5,14,18,7,4,12,13,8,3,10,9,11,2/E:(3,4)(7,8)/rA:18nCSCCCCCCNCOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NOS
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.9116
Area:450.926
Solvation:-2.36156
Coulombic:-22.9275
Bond Count [?]
All:19
Single:12
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:257.352
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.55
LogP (Chemaxon):3.87

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Descriptor Annotations

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