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Chemical ID: 5997538

Cc1ccc(cc1)C(=O)N(C)CC(=O)N2CCCCC2c3nc(no3)c4cccc(c4)Cl

Chemical ID:

5997538

Name [?]:

N-[[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]carbonylmethyl]-N,4-dimethyl-benzamide

SMILES [?]:

Cc1ccc(cc1)C(=O)N(C)CC(=O)N2CCCCC2c3nc(no3)c4cccc(c4)Cl

InChi [?]:

InChI=1/C24H25ClN4O3/c1-16-9-11-17(12-10-16)24(31)28(2)15-21(30)29-13-4-3-8-20(29)23-26-22(27-32-23)18-6-5-7-19(25)14-18/h5-7,9-12,14,20H,3-4,8,13,15H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,11,18,17,28,27,29,19,3,7,4,6,16,31,12,2,5,26,30,20,13,23,21,8,32,22,24,10,15,14,9,25/E:(9,10)(11,12)/rA:32cCCCCCCCCONCCCONCCCCCCNCNOCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;s10;s12;d13;s13;s15;s16;s17;s18;s15s19;s20;d21;s22;d23;s21s24;s23;s26;d27;s28;d29;d26s30;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₅ClN₄O₃
All Atoms:	32
Heavy Atoms:	32
Chiral Atoms:	1

ZAP Information [?]

Total:	12.363
Area:	665.612
Solvation:	-4.2773
Coulombic:	-47.2876

Bond Count [?]

All:	35
Single:	25
Double:	10
Rotors:	7
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	452.933
H-Bond Donors:	0
H-Bond Acceptors:	4
XLogP:	4.76
LogP (Chemaxon):	4.04

Name Annotations

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

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