Chemical ID: 4564413

CC(=O)N(CCC(c1ccccc1)c2ccc(cc2)OC)CC3CCOC(C3)(C)C
Chemical ID:
4564413
Name [?]:
N-[(2,2-dimethyltetrahydropyran-4-yl)methyl]-N-[3-(4-methoxyphenyl)-3-phenyl-propyl]-acetamide
SMILES [?]:
CC(=O)N(CCC(c1ccccc1)c2ccc(cc2)OC)CC3CCOC(C3)(C)C
InChi [?]:
InChI=1/C26H35NO3/c1-20(28)27(19-21-15-17-30-26(2,3)18-21)16-14-25(22-8-6-5-7-9-22)23-10-12-24(29-4)13-11-23/h5-13,21,25H,14-19H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,29,30,21,11,10,12,9,13,15,19,16,18,6,24,5,25,28,22,2,23,8,14,17,7,27,4,3,20,26/E:(2,3)(6,7)(8,9)(10,11)(12,13)/rA:30cCCONCCCCCCCCCCCCCCCOCCCCCOCCCC/rB:s1;d2;s2;s4;s5;s6;s7;s8;d9;s10;d11;d8s12;s7;s14;d15;s16;d17;d14s18;s17;s20;s4;s22;s23;s24;s25;s26;s23s27;s27;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C26H35NO3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:2
ZAP Information [?]
Total:11.2315
Area:657.415
Solvation:-5.20387
Coulombic:-32.9612
Bond Count [?]
All:32
Single:25
Double:7
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:409.561
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.91
LogP (Chemaxon):3.93

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Descriptor Annotations

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