Chemical ID: 7678563

c1cc(cc(c1)Cl)n2c3c(c(=O)n(cn3)CC(=O)N4CCOCC4)nn2
Chemical ID:
7678563
Name [?]:
None
SMILES [?]:
c1cc(cc(c1)Cl)n2c3c(c(=O)n(cn3)CC(=O)N4CCOCC4)nn2
InChi [?]:
InChI=1/C16H15ClN6O3/c17-11-2-1-3-12(8-11)23-15-14(19-20-23)16(25)22(10-18-15)9-13(24)21-4-6-26-7-5-21/h1-3,8,10H,4-7,9H2
InChi Info:
AuxInfo=1/0/N:1,6,2,20,24,21,23,4,16,14,5,3,17,10,9,11,7,15,25,26,19,13,8,18,12,22/E:(4,5)(6,7)/rA:26nCCCCCCClNCCCONCNCCONCCOCCNN/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;d9;s10;d11;s11;s13;s9d14;s13;s16;d17;s17;s19;s20;s21;s22;s19s23;s10;s8d25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15ClN6O3
All Atoms:41
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:8.99241
Area:564.933
Solvation:-5.13093
Coulombic:-51.2599
Bond Count [?]
All:29
Single:21
Double:8
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:0.0
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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