Chemical ID: 5605858

CCCCCNS(=O)(=O)c1ccccc1S(=O)(=O)NCCCCC
Chemical ID:
5605858
Name [?]:
N,N'-dipentylbenzene-1,2-disulfonamide
SMILES [?]:
CCCCCNS(=O)(=O)c1ccccc1S(=O)(=O)NCCCCC
InChi [?]:
InChI=1/C16H28N2O4S2/c1-3-5-9-13-17-23(19,20)15-11-7-8-12-16(15)24(21,22)18-14-10-6-4-2/h7-8,11-12,17-18H,3-6,9-10,13-14H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,24,2,23,3,22,12,13,4,21,11,14,5,20,10,15,6,19,8,9,17,18,7,16/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20,21,22)(23,24)/CRV:23.6,24.6/rA:24nCCCCCNSOOCCCCCCSOONCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;d7;s7;s10;d11;s12;d13;d10s14;s15;d16;d16;s16;s19;s20;s21;s22;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H28N2O4S2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:12.2401
Area:591.255
Solvation:-2.54126
Coulombic:-25.7582
Bond Count [?]
All:24
Single:17
Double:7
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:376.537
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.56
LogP (Chemaxon):3.01

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Descriptor Annotations

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