Chemical ID: 6685213

CCNc1nc(nc(n1)O)NC(C)C
Chemical ID:
6685213
Name [?]:
4-ethylamino-6-isopropylamino-1,3,5-triazin-2-ol
SMILES [?]:
CCNc1nc(nc(n1)O)NC(C)C
InChi [?]:
InChI=1/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,13,14,2,12,4,6,8,3,11,5,9,7,10/E:(2,3)/rA:14nCCNCNCNCNONCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s6;s11;s12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H15N5O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.14051
Area:388.727
Solvation:-1.57766
Coulombic:-60.9631
Bond Count [?]
All:14
Single:11
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:197.238
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:1.28
LogP (Chemaxon):1.59

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Descriptor Annotations

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