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Chemical ID: 6883730

c1ccc2c(c1)cccc2NC(=O)COc3ccc(cc3)C(=O)Nc4ccccc4Cl

Chemical ID:

6883730

Name [?]:

N-(2-chlorophenyl)-4-(1-naphthylcarbamoylmethoxy)benzamide

SMILES [?]:

c1ccc2c(c1)cccc2NC(=O)COc3ccc(cc3)C(=O)Nc4ccccc4Cl

InChi [?]:

InChI=1/C25H19ClN2O3/c26-21-9-3-4-10-23(21)28-25(30)18-12-14-19(15-13-18)31-16-24(29)27-22-11-5-7-17-6-1-2-8-20(17)22/h1-15H,16H2,(H,27,29)(H,28,30)

InChi Info:

AuxInfo=1/1/N:1,2,28,27,8,6,7,3,29,26,9,18,20,17,21,14,5,19,16,4,30,10,25,12,22,31,11,24,13,23,15/E:(12,13)(14,15)/rA:31nCCCCCCCCCCNCOCOCCCCCCCONCCCCCCCl/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s19;d22;s22;s24;s25;d26;s27;d28;d25s29;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₅H₁₉ClN₂O₃
All Atoms:	50
Heavy Atoms:	31
Chiral Atoms:	0

ZAP Information [?]

Total:	11.5154
Area:	664.326
Solvation:	-5.09275
Coulombic:	-52.4967

Bond Count [?]

All:	34
Single:	21
Double:	13
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	430.883
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	5.53
LogP (Chemaxon):	4.8

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