Chemical ID: 4673811

c1ccc(cc1)C(=O)NCSc2ccncn2
Chemical ID:
4673811
Name [?]:
N-(pyrimidin-4-ylsulfanylmethyl)benzamide
SMILES [?]:
c1ccc(cc1)C(=O)NCSc2ccncn2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H11N3OS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.42194
Area:433.272
Solvation:-2.40985
Coulombic:-33.4648
Bond Count [?]
All:18
Single:11
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:245.301
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.35
LogP (Chemaxon):2.12

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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