Chemical ID: 7255043

CCCc1ccc(cc1)S(=O)(=O)Nc2ccc(c(c2)S(=O)(=O)N(C)C)C
Chemical ID:
7255043
Name [?]:
N,N,2-trimethyl-5-(4-propylphenyl)sulfonylamino-benzenesulfonamide
SMILES [?]:
CCCc1ccc(cc1)S(=O)(=O)Nc2ccc(c(c2)S(=O)(=O)N(C)C)C
InChi [?]:
InChI=1/C18H24N2O4S2/c1-5-6-15-8-11-17(12-9-15)25(21,22)19-16-10-7-14(2)18(13-16)26(23,24)20(3)4/h7-13,19H,5-6H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,26,24,25,2,3,16,5,9,15,6,8,19,17,4,14,7,18,13,23,11,12,21,22,10,20/E:(3,4)(8,9)(11,12)(21,22)(23,24)/CRV:25.6,26.6/rA:26nCCCCCCCCCSOONCCCCCCSOONCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;d10;s10;s13;s14;d15;s16;d17;d14s18;s18;d20;d20;s20;s23;s23;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H24N2O4S2
All Atoms:50
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.6547
Area:546.27
Solvation:-3.00206
Coulombic:-20.3482
Bond Count [?]
All:27
Single:17
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:396.526
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.5
LogP (Chemaxon):3.46

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Descriptor Annotations

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