Chemical ID: 6555692

c1ccc2cc(ccc2c1)SCC(=O)Nc3ccccc3N4CCOCC4
Chemical ID:
6555692
Name [?]:
N-(2-morpholinophenyl)-2-(2-naphthylsulfanyl)acetamide
SMILES [?]:
c1ccc2cc(ccc2c1)SCC(=O)Nc3ccccc3N4CCOCC4
InChi [?]:
InChI=1/C22H22N2O2S/c25-22(16-27-19-10-9-17-5-1-2-6-18(17)15-19)23-20-7-3-4-8-21(20)24-11-13-26-14-12-24/h1-10,15H,11-14,16H2,(H,23,25)
InChi Info:
AuxInfo=1/1/N:1,2,18,19,10,3,17,20,8,7,23,27,24,26,5,12,9,4,6,16,21,13,15,22,14,25,11/E:(11,12)(13,14)/rA:27nCCCCCCCCCCSCCONCCCCCCNCCOCC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;s22;s23;s24;s25;s22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H22N2O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.5148
Area:597.706
Solvation:-4.42781
Coulombic:-37.5321
Bond Count [?]
All:30
Single:21
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:378.488
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.31
LogP (Chemaxon):4.39

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Descriptor Annotations

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