Chemical ID: 4917593

CC(=O)Nc1ccccc1S(=O)c2ccccc2
Chemical ID:
4917593
Name [?]:
N-(2-phenylsulfinylphenyl)acetamide
SMILES [?]:
CC(=O)Nc1ccccc1S(=O)c2ccccc2
InChi [?]:
InChI=1/C14H13NO2S/c1-11(16)15-13-9-5-6-10-14(13)18(17)12-7-3-2-4-8-12/h2-10H,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,7,8,14,18,6,9,2,13,5,10,4,3,12,11/E:(3,4)(7,8)/rA:18cCCONCCCCCCSOCCCCCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s10;d11;s11;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13NO2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.90434
Area:424.474
Solvation:-2.70751
Coulombic:-25.8224
Bond Count [?]
All:19
Single:11
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:259.325
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.87
LogP (Chemaxon):2.56

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