Chemical ID: 4166664

Cc1cc(c2cc3c(nc2c1)n(c(=O)n(c3=O)C)C)C
Chemical ID:
4166664
Name [?]:
None
SMILES [?]:
Cc1cc(c2cc3c(nc2c1)n(c(=O)n(c3=O)C)C)C
InChi [?]:
InChI=1/C15H15N3O2/c1-8-5-9(2)10-7-11-13(16-12(10)6-8)17(3)15(20)18(4)14(11)19/h5-7H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,20,19,18,3,11,6,2,4,5,7,10,8,16,13,9,12,15,17,14/rA:20nCCCCCCCCNCCNCONCOCCC/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;d2s10;s8;s12;d13;s13;s7s15;d16;s15;s12;s4;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15N3O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.99461
Area:434.398
Solvation:-1.86534
Coulombic:-41.1582
Bond Count [?]
All:22
Single:15
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:269.299
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.47
LogP (Chemaxon):3.09

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Descriptor Annotations

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