Chemical ID: 7712905

CCC(C(=O)Nc1ccccc1F)n2c(c(nn2)C(=O)OC)C(=O)OC
Chemical ID:
7712905
Name [?]:
None
SMILES [?]:
CCC(C(=O)Nc1ccccc1F)n2c(c(nn2)C(=O)OC)C(=O)OC
InChi [?]:
InChI=1/C16H17FN4O5/c1-4-11(14(22)18-10-8-6-5-7-9(10)17)21-13(16(24)26-3)12(19-20-21)15(23)25-2/h5-8,11H,4H2,1-3H3,(H,18,22)
InChi Info:
AuxInfo=1/1/N:1,22,26,2,10,9,11,8,12,7,3,16,15,4,19,23,13,6,17,18,14,5,20,24,21,25/rA:26cCCCCONCCCCCCFNCCNNCOOCCOOC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s3;s14;d15;s16;s14d17;s16;d19;s19;s21;s15;d23;s23;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17FN4O5
All Atoms:43
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:8.9161
Area:554.954
Solvation:-4.95776
Coulombic:-68.7758
Bond Count [?]
All:27
Single:19
Double:8
Rotors:9
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.58
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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