Chemical ID: 7028583

COC(=O)c1ccccc1NC(=O)c2ccc(o2)c3ccc(cc3Cl)Cl
Chemical ID:
7028583
Name [?]:
methyl 2-[[5-(2,4-dichlorophenyl)-2-furyl]carbonylamino]benzoate
SMILES [?]:
COC(=O)c1ccccc1NC(=O)c2ccc(o2)c3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C19H13Cl2NO4/c1-25-19(24)13-4-2-3-5-15(13)22-18(23)17-9-8-16(26-17)12-7-6-11(20)10-14(12)21/h2-10H,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,7,8,6,9,21,20,16,15,23,22,19,5,24,10,17,14,12,3,26,25,11,13,4,2,18/rA:26nCOCOCCCCCCNCOCCCCOCCCCCCClCl/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;d14;s15;d16;s14s17;s17;s19;d20;s21;d22;d19s23;s24;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H13Cl2NO4
All Atoms:39
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.6471
Area:589.093
Solvation:-3.08024
Coulombic:-52.2612
Bond Count [?]
All:28
Single:18
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:390.216
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.26
LogP (Chemaxon):4.73

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