Chemical ID: 7489216

CC(C(=O)Nc1ccccc1C(=O)NCCc2ccccc2)Oc3ccc(cc3)OC
Chemical ID:
7489216
Name [?]:
2-[2-(4-methoxyphenoxy)propanoylamino]-N-phenethyl-benzamide
SMILES [?]:
CC(C(=O)Nc1ccccc1C(=O)NCCc2ccccc2)Oc3ccc(cc3)OC
InChi [?]:
InChI=1/C25H26N2O4/c1-18(31-21-14-12-20(30-2)13-15-21)24(28)27-23-11-7-6-10-22(23)25(29)26-17-16-19-8-4-3-5-9-19/h3-15,18H,16-17H2,1-2H3,(H,26,29)(H,27,28)
InChi Info:
AuxInfo=1/1/N:1,31,20,19,21,9,8,18,22,10,7,26,28,25,29,16,15,2,17,27,24,11,6,3,12,14,5,4,13,30,23/E:(4,5)(8,9)(12,13)(14,15)/rA:31cCCCONCCCCCCCONCCCCCCCCOCCCCCCOC/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s11;d12;s12;s14;s15;s16;s17;d18;s19;d20;d17s21;s2;s23;s24;d25;s26;d27;d24s28;s27;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H26N2O4
All Atoms:57
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:11.5541
Area:686.451
Solvation:-5.60715
Coulombic:-60.1916
Bond Count [?]
All:33
Single:22
Double:11
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:418.485
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.82
LogP (Chemaxon):4.74

Name Annotations

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Descriptor Annotations

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