Chemical ID: 6492077

Cc1cc(nc(n1)SN2CCCCC2)C
Chemical ID:
6492077
Name [?]:
4,6-dimethyl-2-(1-piperidylsulfanyl)pyrimidine
SMILES [?]:
Cc1cc(nc(n1)SN2CCCCC2)C
InChi [?]:
InChI=1/C11H17N3S/c1-9-8-10(2)13-11(12-9)15-14-6-4-3-5-7-14/h8H,3-7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,15,12,11,13,10,14,3,2,4,6,7,5,9,8/E:(1,2)(4,5)(6,7)(9,10)(12,13)/rA:15nCCCCNCNSNCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s11;s12;s9s13;s4;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17N3S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.51761
Area:402.474
Solvation:-1.54424
Coulombic:-14.7436
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:223.339
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.62
LogP (Chemaxon):1.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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