Chemical ID: 7488304

CCCCOc1ccccc1C(=O)NCCCNC(=O)c2ccccc2OCCCC
Chemical ID:
7488304
Name [?]:
2-butoxy-N-[3-(2-butoxybenzoyl)aminopropyl]benzamide
SMILES [?]:
CCCCOc1ccccc1C(=O)NCCCNC(=O)c2ccccc2OCCCC
InChi [?]:
InChI=1/C25H34N2O4/c1-3-5-18-30-22-14-9-7-12-20(22)24(28)26-16-11-17-27-25(29)21-13-8-10-15-23(21)31-19-6-4-2/h7-10,12-15H,3-6,11,16-19H2,1-2H3,(H,26,28)(H,27,29)
InChi Info:
AuxInfo=1/1/N:1,31,2,30,3,29,9,23,8,24,16,10,22,7,25,15,17,4,28,11,21,6,26,12,19,14,18,13,20,5,27/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(14,15)(16,17)(18,19)(20,21)(22,23)(24,25)(26,27)(28,29)(30,31)/gE:(1,2)/rA:31nCCCCOCCCCCCCONCCCNCOCCCCCCOCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;d12;s12;s14;s15;s16;s17;s18;d19;s19;s21;d22;s23;d24;d21s25;s26;s27;s28;s29;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H34N2O4
All Atoms:65
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:11.8633
Area:745.398
Solvation:-6.77162
Coulombic:-58.7984
Bond Count [?]
All:32
Single:24
Double:8
Rotors:16
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:426.549
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.53
LogP (Chemaxon):3.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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