Chemical ID: 4797234

C1CCN(CC1)c2c(nsn2)Cl
Chemical ID:
4797234
Name [?]:
1-(4-chloro-1,2,5-thiadiazol-3-yl)piperidine
SMILES [?]:
C1CCN(CC1)c2c(nsn2)Cl
InChi [?]:
InChI=1/C7H10ClN3S/c8-6-7(10-12-9-6)11-4-2-1-3-5-11/h1-5H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,8,7,12,9,11,4,10/E:(2,3)(4,5)/rA:12nCCCNCCCCNSNCl/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;s9;d7s10;s8;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10ClN3S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.81304
Area:340.011
Solvation:-0.687236
Coulombic:-16.7442
Bond Count [?]
All:13
Single:11
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:203.693
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.48
LogP (Chemaxon):2.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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