Chemical ID: 6294103

COCc1nnc(o1)NC(=O)CSc2nc[nH]n2
Chemical ID:
6294103
Name [?]:
N-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]-2-(1H-1,2,4-triazol-3-ylsulfanyl)acetamide
SMILES [?]:
COCc1nnc(o1)NC(=O)CSc2nc[nH]n2
InChi [?]:
InChI=1/C8H10N6O3S/c1-16-2-6-12-13-7(17-6)11-5(15)3-18-8-9-4-10-14-8/h4H,2-3H2,1H3,(H,9,10,14)(H,11,13,15)
InChi Info:
AuxInfo=1/1/N:1,3,12,16,10,4,7,14,15,17,9,5,6,18,11,2,8,13/rA:18nCOCCNNCONCOCSCNCNN/rB:s1;s2;s3;d4;s5;d6;s4s7;s7;s9;d10;s10;s12;s13;s14;d15;s16;d14s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H10N6O3S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:5.98559
Area:464.107
Solvation:-5.61709
Coulombic:-56.4894
Bond Count [?]
All:19
Single:14
Double:5
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:270.27
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.6
LogP (Chemaxon):-0.86

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Descriptor Annotations

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