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Chemical ID: 5110058
Chemical ID:
5110058
Name [?]:
N-thiadiazol-4-ylfuran-2-carboxamide
SMILES [?]:
c1cc(oc1)C(=O)Nc2csnn2
InChi [?]:
InChI=1/C7H5N3O2S/c11-7(5-2-1-3-12-5)8-6-4-13-10-9-6/h1-4H,(H,8,11)
InChi Info:
AuxInfo=1/1/N:1,2,5,10,3,9,6,8,13,12,7,4,11/rA:13nCCCOCCONCCSNN/rB:s1;d2;s3;d1s4;s3;d6;s6;s8;d9;s10;s11;s9d12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H5N3O2S |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.70319 |
Area: | 349.505 |
Solvation: | -2.03444 |
Coulombic: | -31.6546 |
Bond Count [?]
All: | 14 |
Single: | 9 |
Double: | 5 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 195.2 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 1.64 |
LogP (Chemaxon): | 0.75 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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