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Chemical ID: 5145374

Cc1cccc2c1nc(cc2C)NN=Cc3ccc(cc3)N4CCOCC4

Chemical ID:

5145374

Name [?]:

4,8-dimethyl-N-[(4-morpholinophenyl)methyleneamino]quinolin-2-amine

SMILES [?]:

Cc1cccc2c1nc(cc2C)NN=Cc3ccc(cc3)N4CCOCC4

InChi [?]:

InChI=1/C22H24N4O/c1-16-4-3-5-20-17(2)14-21(24-22(16)20)25-23-15-18-6-8-19(9-7-18)26-10-12-27-13-11-26/h3-9,14-15H,10-13H2,1-2H3,(H,24,25)

InChi Info:

AuxInfo=1/1/N:1,12,4,3,5,17,21,18,20,23,27,24,26,10,15,2,11,16,19,6,9,7,14,8,13,22,25/E:(6,7)(8,9)(10,11)(12,13)/rA:27nCCCCCCCNCCCCNNCCCCCCCNCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s9;s6d10;s11;s9;s13;w14;s15;s16;d17;s18;d19;d16s20;s19;s22;s23;s24;s25;s22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₄N₄O
All Atoms:	27
Heavy Atoms:	27
Chiral Atoms:	0

ZAP Information [?]

Total:	9.84715
Area:	580.755
Solvation:	-4.67174
Coulombic:	-30.1745

Bond Count [?]

All:	30
Single:	21
Double:	9
Rotors:	4
Chiral:	1
Rigid Segments:	4

Chemical Properties

Molecular Weight:	360.452
H-Bond Donors:	1
H-Bond Acceptors:	4
XLogP:	5.64
LogP (Chemaxon):	5.45

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value