Chemical ID: 7256825

CCCn1c(c(c(=O)[nH]c1=O)NC(C)CCCC(C)C)N
Chemical ID:
7256825
Name [?]:
6-amino-5-(1,5-dimethylhexylamino)-1-propyl-pyrimidine-2,4-dione
SMILES [?]:
CCCn1c(c(c(=O)[nH]c1=O)NC(C)CCCC(C)C)N
InChi [?]:
InChI=1/C15H28N4O2/c1-5-9-19-13(16)12(14(20)18-15(19)21)17-11(4)8-6-7-10(2)3/h10-11,17H,5-9,16H2,1-4H3,(H,18,20,21)
InChi Info:
AuxInfo=1/1/N:1,19,20,14,2,16,17,15,3,18,13,6,5,7,10,21,12,9,4,8,11/E:(2,3)/rA:21cCCCNCCCONCONCCCCCCCCN/rB:s1;s2;s3;s4;d5;s6;d7;s7;s4s9;d10;s6;s12;s13;s13;s15;s16;s17;s18;s18;s5;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H28N4O2
All Atoms:49
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:11.1231
Area:518.331
Solvation:-1.83519
Coulombic:-69.3121
Bond Count [?]
All:21
Single:18
Double:3
Rotors:8
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.409
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:3.58
LogP (Chemaxon):2.28

Name Annotations

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Descriptor Annotations

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