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Chemical ID: 5999965

CCCN(CC(=O)N1CCCCC1c2nc(no2)c3ccc(cc3)Cl)C(=O)CCC4CCCC4

Chemical ID:

5999965

Name [?]:

N-[[2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]carbonylmethyl]-3-cyclopentyl-N-propyl-propanamide

SMILES [?]:

CCCN(CC(=O)N1CCCCC1c2nc(no2)c3ccc(cc3)Cl)C(=O)CCC4CCCC4

InChi [?]:

InChI=1/C26H35ClN4O3/c1-2-16-30(23(32)15-10-19-7-3-4-8-19)18-24(33)31-17-6-5-9-22(31)26-28-25(29-34-26)20-11-13-21(27)14-12-20/h11-14,19,22H,2-10,15-18H2,1H3

InChi Info:

AuxInfo=1/0/N:1,2,32,33,11,10,31,34,12,29,20,24,21,23,28,3,9,5,30,19,22,13,26,6,16,14,25,15,17,4,8,27,7,18/E:(3,4)(7,8)(11,12)(13,14)/rA:34cCCCNCCONCCCCCCNCNOCCCCCCClCOCCCCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s8s12;s13;d14;s15;d16;s14s17;s16;s19;d20;s21;d22;d19s23;s22;s4;d26;s26;s28;s29;s30;s31;s32;s30s33;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₆H₃₅ClN₄O₃
All Atoms:	34
Heavy Atoms:	34
Chiral Atoms:	1

ZAP Information [?]

Total:	14.3273
Area:	749.775
Solvation:	-4.41711
Coulombic:	-46.0408

Bond Count [?]

All:	37
Single:	30
Double:	7
Rotors:	11
Chiral:	0
Rigid Segments:	9

Chemical Properties

Molecular Weight:	487.034
H-Bond Donors:	0
H-Bond Acceptors:	4
XLogP:	6.08
LogP (Chemaxon):	4.69

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