Chemical ID: 7670027

Cc1cc2[nH]c(cc(=O)n2n1)N(c3cc(nn3C(=O)C)C)C(=O)C
Chemical ID:
7670027
Name [?]:
None
SMILES [?]:
Cc1cc2[nH]c(cc(=O)n2n1)N(c3cc(nn3C(=O)C)C)C(=O)C
InChi [?]:
InChI=1/C15H16N6O3/c1-8-5-13-16-12(7-15(24)21(13)18-8)19(10(3)22)14-6-9(2)17-20(14)11(4)23/h5-7,16H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,21,24,20,3,14,7,2,15,22,18,6,4,13,8,5,16,11,12,17,10,23,19,9/rA:24nCCCCNCCCONNNCCCNNCOCCCOC/rB:s1;s2;d3;s4;s5;d6;s7;d8;s4s8;d2s10;s6;s12;d13;s14;d15;s13s16;s17;d18;s18;s15;s12;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16N6O3
All Atoms:40
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:7.91751
Area:511.508
Solvation:-4.87018
Coulombic:-51.0474
Bond Count [?]
All:26
Single:18
Double:8
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.35
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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