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Chemical ID: 4463716

COc1cc(ccc1NC(=O)Cc2ccccc2)NC(=O)Cc3ccccc3

Chemical ID:

4463716

Name [?]:

N-[2-methoxy-4-(2-phenylacetyl)amino-phenyl]-2-phenyl-acetamide

SMILES [?]:

COc1cc(ccc1NC(=O)Cc2ccccc2)NC(=O)Cc3ccccc3

InChi [?]:

InChI=1/C23H22N2O3/c1-28-21-16-19(24-22(26)14-17-8-4-2-5-9-17)12-13-20(21)25-23(27)15-18-10-6-3-7-11-18/h2-13,16H,14-15H2,1H3,(H,24,26)(H,25,27)

InChi Info:

AuxInfo=1/1/N:1,26,16,25,27,15,17,24,28,14,18,6,7,22,12,4,23,13,5,8,3,20,10,19,9,21,11,2/E:(4,5)(6,7)(8,9)(10,11)/rA:28nCOCCCCCCNCOCCCCCCCNCOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s5;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:	10.0597
Area:	618.537
Solvation:	-5.40369
Coulombic:	-48.5867

Bond Count [?]

All:	30
Single:	19
Double:	11
Rotors:	9
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	374.432
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	3.08
LogP (Chemaxon):	4.14

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