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Chemical ID: 4158870

Cc1cccc(c1C)NC(=O)c2ccc(cc2)OCC(=O)Nc3ccccc3

Chemical ID:

4158870

Name [?]:

N-(2,3-dimethylphenyl)-4-(phenylcarbamoylmethoxy)benzamide

SMILES [?]:

Cc1cccc(c1C)NC(=O)c2ccc(cc2)OCC(=O)Nc3ccccc3

InChi [?]:

InChI=1/C23H22N2O3/c1-16-7-6-10-21(17(16)2)25-23(27)18-11-13-20(14-12-18)28-15-22(26)24-19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,24,26)(H,25,27)

InChi Info:

AuxInfo=1/1/N:1,8,26,25,27,4,3,24,28,5,13,17,14,16,19,2,7,12,23,15,6,20,10,22,9,21,11,18/E:(4,5)(8,9)(11,12)(13,14)/rA:28nCCCCCCCCNCOCCCCCCOCCONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;s18;s19;d20;s20;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₂N₂O₃
All Atoms:	28
Heavy Atoms:	28
Chiral Atoms:	0

ZAP Information [?]

Total:	10.2201
Area:	616.635
Solvation:	-5.19577
Coulombic:	-50.4468

Bond Count [?]

All:	30
Single:	19
Double:	11
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	374.432
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	4.31
LogP (Chemaxon):	4.22

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