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Chemical ID: 6496172

Chemical ID:

6496172

Name [?]:

N-[(4-dimethylaminophenyl)methyleneamino]-2-(4-methoxyphenyl)amino-acetamide

SMILES [?]:

CN(C)c1ccc(cc1)C=NNC(=O)CNc2ccc(cc2)OC

InChi [?]:

InChI=1/C18H22N4O2/c1-22(2)16-8-4-14(5-9-16)12-20-21-18(23)13-19-15-6-10-17(24-3)11-7-15/h4-12,19H,13H2,1-3H3,(H,21,23)

InChi Info:

AuxInfo=1/1/N:1,3,24,6,8,18,22,5,9,19,21,10,15,7,17,4,20,13,16,11,12,2,14,23/E:(1,2)(4,5)(6,7)(8,9)(10,11)/rA:24nCNCCCCCCCCNNCOCNCCCCCCOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;w10;s11;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s20;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₂N₄O₂
All Atoms:	24
Heavy Atoms:	24
Chiral Atoms:	0

ZAP Information [?]

Total:	8.69839
Area:	571.719
Solvation:	-5.59457
Coulombic:	-43.3337

Bond Count [?]

All:	25
Single:	17
Double:	8
Rotors:	8
Chiral:	1
Rigid Segments:	7

Chemical Properties

Molecular Weight:	326.393
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	3.53
LogP (Chemaxon):	2.85

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value