Chemical ID: 3869414

c1ccc(cc1)CC(=O)Nc2ccc(cc2)C(=O)NCc3cccnc3
Chemical ID:
3869414
Name [?]:
4-(2-phenylacetyl)amino-N-(3-pyridylmethyl)benzamide
SMILES [?]:
c1ccc(cc1)CC(=O)Nc2ccc(cc2)C(=O)NCc3cccnc3
InChi [?]:
InChI=1/C21H19N3O2/c25-20(13-16-5-2-1-3-6-16)24-19-10-8-18(9-11-19)21(26)23-15-17-7-4-12-22-14-17/h1-12,14H,13,15H2,(H,23,26)(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,6,23,3,5,22,13,15,12,16,24,7,26,20,4,21,14,11,8,17,25,19,10,9,18/E:(2,3)(5,6)(8,9)(10,11)/rA:26nCCCCCCCCONCCCCCCCONCCCCCNC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;d17;s17;s19;s20;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H19N3O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.4875
Area:590.6
Solvation:-4.27748
Coulombic:-47.3956
Bond Count [?]
All:28
Single:17
Double:11
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:345.395
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.67
LogP (Chemaxon):2.58

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