Chemical ID: 6529106

CCN(CCNC(=O)c1ccc(cc1)F)C(=O)c2ccc(cc2)F
Chemical ID:
6529106
Name [?]:
N-[2-[ethyl-(4-fluorobenzoyl)-amino]ethyl]-4-fluoro-benzamide
SMILES [?]:
CCN(CCNC(=O)c1ccc(cc1)F)C(=O)c2ccc(cc2)F
InChi [?]:
InChI=1/C18H18F2N2O2/c1-2-22(18(24)14-5-9-16(20)10-6-14)12-11-21-17(23)13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,2,10,14,19,23,11,13,20,22,5,4,9,18,12,21,7,16,15,24,6,3,8,17/E:(3,4)(5,6)(7,8)(9,10)/rA:24nCCNCCNCOCCCCCCFCOCCCCCCF/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;d10;s11;d12;d9s13;s12;s3;d16;s16;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18F2N2O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.83841
Area:539.226
Solvation:-4.64224
Coulombic:-47.4183
Bond Count [?]
All:25
Single:17
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:332.345
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.53
LogP (Chemaxon):2.58

Name Annotations

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Descriptor Annotations

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