ChemicalDetail: Details for an Individual Chemical

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Chemical ID: 7673609

Chemical ID:

7673609

Name [?]:

None

SMILES [?]:

C1CCC(CC1)NS(=O)(=O)NC2CCCCC2

InChi [?]:

InChI=1/C12H24N2O2S/c15-17(16,13-11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h11-14H,1-10H2

InChi Info:

AuxInfo=1/0/N:1,15,2,6,14,16,3,5,13,17,4,12,7,11,9,10,8/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(13,14)(15,16)/CRV:17.6/rA:17nCCCCCCNSOONCCCCCC/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;d8;s8;s11;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₂H₂₄N₂O₂S
All Atoms:	41
Heavy Atoms:	17
Chiral Atoms:	None

ZAP Information [?]

Total:	9.01282
Area:	423.603
Solvation:	-1.57726
Coulombic:	-20.4804

Bond Count [?]

All:	18
Single:	16
Double:	2
Rotors:	4
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	2.4
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value