Chemical ID: 4256781

CSc1nnc(s1)N
Chemical ID:
4256781
Name [?]:
5-methylsulfanyl-1,3,4-thiadiazol-2-amine
SMILES [?]:
CSc1nnc(s1)N
InChi [?]:
InChI=1/C3H5N3S2/c1-7-3-6-5-2(4)8-3/h1H3,(H2,4,5)
InChi Info:
AuxInfo=1/1/N:1,6,3,8,5,4,2,7/rA:8nCSCNNCSN/rB:s1;s2;d3;s4;d5;s3s6;s6;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C3H5N3S2
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:6.5193
Area:292.178
Solvation:-0.78514
Coulombic:-22.7455
Bond Count [?]
All:8
Single:6
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:147.224
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.23
LogP (Chemaxon):0.75

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Experimental Annotations

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Descriptor Annotations

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