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Chemical ID: 7256845

Chemical ID:

7256845

Name [?]:

3-acetamido-N-(2,4-dimethoxyphenyl)-benzamide

SMILES [?]:

CC(=O)Nc1cccc(c1)C(=O)Nc2ccc(cc2OC)OC

InChi [?]:

InChI=1/C17H18N2O4/c1-11(20)18-13-6-4-5-12(9-13)17(21)19-15-8-7-14(22-2)10-16(15)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)

InChi Info:

AuxInfo=1/1/N:1,23,21,7,8,6,16,15,10,18,2,9,5,17,14,19,11,4,13,3,12,22,20/rA:23nCCONCCCCCCCONCCCCCCOCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s20;s17;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₇H₁₈N₂O₄
All Atoms:	41
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	7.9286
Area:	523.235
Solvation:	-5.15227
Coulombic:	-55.0444

Bond Count [?]

All:	24
Single:	16
Double:	8
Rotors:	7
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	314.336
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	2.08
LogP (Chemaxon):	1.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value