Chemical ID: 4465689

Cc1nnc2n1c3ccccc3nc2NC4CCCC4
Chemical ID:
4465689
Name [?]:
None
SMILES [?]:
Cc1nnc2n1c3ccccc3nc2NC4CCCC4
InChi [?]:
InChI=1/C15H17N5/c1-10-18-19-15-14(16-11-6-2-3-7-11)17-12-8-4-5-9-13(12)20(10)15/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,18,19,10,9,17,20,11,8,2,16,12,7,14,5,15,13,3,4,6/E:(2,3)(6,7)/rA:20nCCNNCNCCCCCCNCNCCCCC/rB:s1;d2;s3;d4;s2s5;s6;s7;d8;s9;d10;d7s11;s12;s5d13;s14;s15;s16;s17;s18;s16s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17N5
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.57621
Area:446.439
Solvation:-1.58476
Coulombic:-30.1784
Bond Count [?]
All:23
Single:17
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:267.329
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.73
LogP (Chemaxon):2.25

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Experimental Annotations

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Descriptor Annotations

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