Chemical ID: 5217503

COc1ccc(c(c1)Cl)OC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl
Chemical ID:
5217503
Name [?]:
(2-chloro-4-methoxy-phenyl) [4-chloro-3-(trifluoromethyl)phenyl]aminoformate
SMILES [?]:
COc1ccc(c(c1)Cl)OC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl
InChi [?]:
InChI=1/C15H10Cl2F3NO3/c1-23-9-3-5-13(12(17)7-9)24-14(22)21-8-2-4-11(16)10(6-8)15(18,19)20/h2-7H,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,15,4,16,5,19,8,14,3,18,17,7,6,11,20,24,9,21,22,23,13,12,2,10/E:(18,19,20)/rA:24nCOCCCCCCClOCONCCCCCCCFFFCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s6;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s18;s20;s20;s20;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10Cl2F3NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.78031
Area:532.66
Solvation:-3.53618
Coulombic:-59.2666
Bond Count [?]
All:25
Single:18
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:380.145
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.1
LogP (Chemaxon):5.35

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