Chemical ID: 5187116

CN(C)c1ccccc1C(=O)NN=Cc2cc(ccc2OC)OC
Chemical ID:
5187116
Name [?]:
N-[(2,5-dimethoxyphenyl)methyleneamino]-2-dimethylamino-benzamide
SMILES [?]:
CN(C)c1ccccc1C(=O)NN=Cc2cc(ccc2OC)OC
InChi [?]:
InChI=1/C18H21N3O3/c1-21(2)16-8-6-5-7-15(16)18(22)20-19-12-13-11-14(23-3)9-10-17(13)24-4/h5-12H,1-4H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,3,24,22,7,6,8,5,18,19,16,14,15,17,9,4,20,10,13,12,2,11,23,21/E:(1,2)/rA:24nCNCCCCCCCCONNCCCCCCCOCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s20;s21;s17;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21N3O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:6.95976
Area:527.807
Solvation:-6.23542
Coulombic:-39.1599
Bond Count [?]
All:25
Single:17
Double:8
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:327.378
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.03
LogP (Chemaxon):3.0

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