Chemical ID: 6503853

CCc1ccc(s1)Nc2ncnc(n2)Cl
Chemical ID:
6503853
Name [?]:
4-chloro-N-(5-ethyl-2-thienyl)-1,3,5-triazin-2-amine
SMILES [?]:
CCc1ccc(s1)Nc2ncnc(n2)Cl
InChi [?]:
InChI=1/C9H9ClN4S/c1-2-6-3-4-7(15-6)13-9-12-5-11-8(10)14-9/h3-5H,2H2,1H3,(H,11,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,4,5,11,3,6,13,9,15,12,10,8,14,7/rA:15nCCCCCCSNCNCNCNCl/rB:s1;s2;d3;s4;d5;s3s6;s6;s8;s9;d10;s11;d12;d9s13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H9ClN4S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:9.0296
Area:410.847
Solvation:-1.24158
Coulombic:-31.4196
Bond Count [?]
All:16
Single:11
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:240.713
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.08
LogP (Chemaxon):2.44

Name Annotations

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Descriptor Annotations

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