Chemical ID: 5806729

Cc1ccc(cc1)S(=O)(=O)N2CC3c4ccccc4CCN3C2c5ccccc5
Chemical ID:
5806729
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N2CC3c4ccccc4CCN3C2c5ccccc5
InChi [?]:
InChI=1/C24H24N2O2S/c1-18-11-13-21(14-12-18)29(27,28)26-17-23-22-10-6-5-7-19(22)15-16-25(23)24(26)20-8-3-2-4-9-20/h2-14,23-24H,15-17H2,1H3
InChi Info:
AuxInfo=1/0/N:1,27,26,28,17,16,18,25,29,15,3,7,4,6,20,21,12,2,19,24,5,14,13,23,22,11,9,10,8/E:(3,4)(8,9)(11,12)(13,14)(27,28)/CRV:29.6/rA:29cCCCCCCCSOONCCCCCCCCCCNCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;s11;s12;s13;s14;d15;s16;d17;d14s18;s19;s20;s13s21;s11s22;s23;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H24N2O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:4
ZAP Information [?]
Total:11.9853
Area:582.437
Solvation:-2.5756
Coulombic:-17.2018
Bond Count [?]
All:33
Single:22
Double:11
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:404.526
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.8
LogP (Chemaxon):5.38

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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