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Chemical ID: 6884165

Cc1ccc(cc1Cl)NC(=O)COc2ccc(cc2)C(=O)Nc3ccccc3OC

Chemical ID:

6884165

Name [?]:

4-[(3-chloro-4-methyl-phenyl)carbamoylmethoxy]-N-(2-methoxyphenyl)-benzamide

SMILES [?]:

Cc1ccc(cc1Cl)NC(=O)COc2ccc(cc2)C(=O)Nc3ccccc3OC

InChi [?]:

InChI=1/C23H21ClN2O4/c1-15-7-10-17(13-19(15)24)25-22(27)14-30-18-11-8-16(9-12-18)23(28)26-20-5-3-4-6-21(20)29-2/h3-13H,14H2,1-2H3,(H,25,27)(H,26,28)

InChi Info:

AuxInfo=1/1/N:1,30,25,26,24,27,3,16,18,4,15,19,6,12,2,17,5,14,7,23,28,10,20,8,9,22,11,21,29,13/E:(8,9)(11,12)/rA:30nCCCCCCCClNCOCOCCCCCCCONCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;d20;s20;s22;s23;d24;s25;d26;d23s27;s28;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₁ClN₂O₄
All Atoms:	51
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	10.6958
Area:	666.767
Solvation:	-5.97342
Coulombic:	-58.2682

Bond Count [?]

All:	32
Single:	21
Double:	11
Rotors:	9
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	424.877
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	4.41
LogP (Chemaxon):	4.66

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

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value