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Chemical ID: 7306060

c1ccc(cc1)CCCNC(=O)C(Cc2ccccc2)NC(=O)c3ccccc3

Chemical ID:

7306060

Name [?]:

N-[2-phenyl-1-(3-phenylpropylcarbamoyl)ethyl]benzamide

SMILES [?]:

c1ccc(cc1)CCCNC(=O)C(Cc2ccccc2)NC(=O)c3ccccc3

InChi [?]:

InChI=1/C25H26N2O2/c28-24(22-16-8-3-9-17-22)27-23(19-21-13-6-2-7-14-21)25(29)26-18-10-15-20-11-4-1-5-12-20/h1-9,11-14,16-17,23H,10,15,18-19H2,(H,26,29)(H,27,28)

InChi Info:

AuxInfo=1/1/N:1,18,27,2,6,17,19,26,28,8,3,5,16,20,7,25,29,9,14,4,15,24,13,22,11,10,21,23,12/E:(4,5)(6,7)(8,9)(11,12)(13,14)(16,17)/rA:29cCCCCCCCCCNCOCCCCCCCCNCOCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s13;s21;d22;s22;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₅H₂₆N₂O₂
All Atoms:	55
Heavy Atoms:	29
Chiral Atoms:	1

ZAP Information [?]

Total:	12.9008
Area:	641.403
Solvation:	-3.13425
Coulombic:	-47.8173

Bond Count [?]

All:	31
Single:	20
Double:	11
Rotors:	11
Chiral:	0
Rigid Segments:	8

Chemical Properties

Molecular Weight:	386.486
H-Bond Donors:	2
H-Bond Acceptors:	4
XLogP:	4.8
LogP (Chemaxon):	4.52

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