Chemical ID: 7020447

COc1ccccc1C(=O)NC(c2ccccc2F)NC(=O)c3ccccc3OC
Chemical ID:
7020447
Name [?]:
N-[(2-fluorophenyl)-(2-methoxybenzoyl)amino-methyl]-2-methoxy-benzamide
SMILES [?]:
COc1ccccc1C(=O)NC(c2ccccc2F)NC(=O)c3ccccc3OC
InChi [?]:
InChI=1/C23H21FN2O4/c1-29-19-13-7-4-10-16(19)22(27)25-21(15-9-3-6-12-18(15)24)26-23(28)17-11-5-8-14-20(17)30-2/h3-14,21H,1-2H3,(H,25,27)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,30,15,6,25,16,5,26,14,7,24,17,4,27,13,8,23,18,3,28,12,9,21,19,11,20,10,22,2,29/E:(1,2)(4,5)(7,8)(10,11)(13,14)(16,17)(19,20)(22,23)(25,26)(27,28)(29,30)/gE:(1,2)/rA:30nCOCCCCCCCONCCCCCCCFNCOCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s18;s12;s20;d21;s21;s23;d24;s25;d26;d23s27;s28;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H21FN2O4
All Atoms:51
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:6.638
Area:614.501
Solvation:-8.72453
Coulombic:-60.5246
Bond Count [?]
All:32
Single:21
Double:11
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:408.422
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.58
LogP (Chemaxon):3.46

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Descriptor Annotations

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