Chemical ID: 5480765

Cc1c(nc([nH]c1=O)SC)C
Chemical ID:
5480765
Name [?]:
5,6-dimethyl-2-methylsulfanyl-3H-pyrimidin-4-one
SMILES [?]:
Cc1c(nc([nH]c1=O)SC)C
InChi [?]:
InChI=1/C7H10N2OS/c1-4-5(2)8-7(11-3)9-6(4)10/h1-3H3,(H,8,9,10)
InChi Info:
AuxInfo=1/1/N:1,11,10,2,3,7,5,4,6,8,9/rA:11nCCCNCNCOSCC/rB:s1;d2;s3;d4;s5;s2s6;d7;s5;s9;s3;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10N2OS
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.75011
Area:328.212
Solvation:-1.45519
Coulombic:-26.2799
Bond Count [?]
All:11
Single:8
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:170.233
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.48
LogP (Chemaxon):1.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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