Chemical ID: 7479329

CC(=NNC(=O)c1ccc(cc1)OCc2ccccc2)c3ccc(cc3)N
Chemical ID:
7479329
Name [?]:
N-[1-(4-aminophenyl)ethylideneamino]-4-benzyloxy-benzamide
SMILES [?]:
CC(=NNC(=O)c1ccc(cc1)OCc2ccccc2)c3ccc(cc3)N
InChi [?]:
InChI=1/C22H21N3O2/c1-16(18-7-11-20(23)12-8-18)24-25-22(26)19-9-13-21(14-10-19)27-15-17-5-3-2-4-6-17/h2-14H,15,23H2,1H3,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,18,17,19,16,20,22,26,8,12,23,25,9,11,14,2,15,21,7,24,10,5,27,3,4,6,13/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:27nCCNNCOCCCCCCOCCCCCCCCCCCCCN/rB:s1;w2;s3;s4;d5;s5;s7;d8;s9;d10;d7s11;s10;s13;s14;s15;d16;s17;d18;d15s19;s2;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H21N3O2
All Atoms:48
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.6103
Area:620.015
Solvation:-4.89008
Coulombic:-45.3054
Bond Count [?]
All:29
Single:18
Double:11
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:359.421
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:4.95
LogP (Chemaxon):3.62

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Descriptor Annotations

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