Chemical ID: 4490834

Cc1cc(c(c(c1C)S(=O)(=O)NCc2ccc(cc2)C(=O)N3CCOCC3)C)C
Chemical ID:
4490834
Name [?]:
2,3,5,6-tetramethyl-N-[(4-morpholinocarbonylphenyl)methyl]benzenesulfonamide
SMILES [?]:
Cc1cc(c(c(c1C)S(=O)(=O)NCc2ccc(cc2)C(=O)N3CCOCC3)C)C
InChi [?]:
InChI=1/C22H28N2O4S/c1-15-13-16(2)18(4)21(17(15)3)29(26,27)23-14-19-5-7-20(8-6-19)22(25)24-9-11-28-12-10-24/h5-8,13,23H,9-12,14H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,29,8,28,15,19,16,18,23,27,24,26,3,13,2,4,7,5,14,17,6,20,12,22,21,10,11,25,9/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(15,16)(17,18)(26,27)/CRV:29.6/rA:29nCCCCCCCCSOONCCCCCCCCONCCOCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;d9;d9;s9;s12;s13;s14;d15;s16;d17;d14s18;s17;d20;s20;s22;s23;s24;s25;s22s26;s5;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H28N2O4S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.351
Area:623.45
Solvation:-4.23525
Coulombic:-38.6801
Bond Count [?]
All:31
Single:22
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:416.535
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.05
LogP (Chemaxon):3.37

Name Annotations

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Descriptor Annotations

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