Chemical ID: 4464731

CC(C)C(=O)Nc1ccc(cc1OC)NC(=O)c2ccc(cc2)OC(C)C
Chemical ID:
4464731
Name [?]:
4-isopropoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-benzamide
SMILES [?]:
CC(C)C(=O)Nc1ccc(cc1OC)NC(=O)c2ccc(cc2)OC(C)C
InChi [?]:
InChI=1/C21H26N2O4/c1-13(2)20(24)23-18-11-8-16(12-19(18)26-5)22-21(25)15-6-9-17(10-7-15)27-14(3)4/h6-14H,1-5H3,(H,22,25)(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,3,26,27,14,19,23,9,20,22,8,11,2,25,18,10,21,7,12,4,16,15,6,5,17,13,24/E:(1,2)(3,4)(6,7)(9,10)/rA:27nCCCCONCCCCCCOCNCOCCCCCCOCCC/rB:s1;s2;s2;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s13;s10;s15;d16;s16;s18;d19;s20;d21;d18s22;s21;s24;s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H26N2O4
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.3584
Area:617.623
Solvation:-5.08221
Coulombic:-56.6393
Bond Count [?]
All:28
Single:20
Double:8
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:370.442
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.08
LogP (Chemaxon):3.87

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