Chemical ID: 7149070

Cc1cc(nn1C)c2nnc(s2)NC
Chemical ID:
7149070
Name [?]:
5-(1,5-dimethylpyrazol-3-yl)-N-methyl-1,3,4-thiadiazol-2-amine
SMILES [?]:
Cc1cc(nn1C)c2nnc(s2)NC
InChi [?]:
InChI=1/C8H11N5S/c1-5-4-6(12-13(5)3)7-10-11-8(9-2)14-7/h4H,1-3H3,(H,9,11)
InChi Info:
AuxInfo=1/1/N:1,14,7,3,2,4,8,11,13,9,10,5,6,12/rA:14nCCCCNNCCNNCSNC/rB:s1;d2;s3;d4;s2s5;s6;s4;d8;s9;d10;s8s11;s11;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H11N5S
All Atoms:25
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.87854
Area:390.248
Solvation:-1.87767
Coulombic:-21.0778
Bond Count [?]
All:15
Single:11
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:209.273
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.58
LogP (Chemaxon):0.52

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Descriptor Annotations

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