Chemical ID: 3961995

c1ccc2c(c1)C(=O)N3CCCC3C(=O)N2Cc4ccc(cc4)F
Chemical ID:
3961995
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)C(=O)N3CCCC3C(=O)N2Cc4ccc(cc4)F
InChi [?]:
InChI=1/C19H17FN2O2/c20-14-9-7-13(8-10-14)12-22-16-5-2-1-4-15(16)18(23)21-11-3-6-17(21)19(22)24/h1-2,4-5,7-10,17H,3,6,11-12H2
InChi Info:
AuxInfo=1/0/N:1,2,11,6,3,12,19,23,20,22,10,17,18,21,5,4,13,7,14,24,9,16,8,15/E:(7,8)(9,10)/rA:24cCCCCCCCONCCCCCONCCCCCCCF/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;s11;s9s12;s13;d14;s4s14;s16;s17;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17FN2O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:8.5195
Area:477.433
Solvation:-3.41633
Coulombic:-39.2909
Bond Count [?]
All:27
Single:19
Double:8
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:324.349
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:2.91
LogP (Chemaxon):2.43

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