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Chemical ID: 7513953

c1cc(cc(c1)Cl)c2ccc(o2)C(=O)Nc3ccc(cc3)NC(=O)c4ccco4

Chemical ID:

7513953

Name [?]:

5-(3-chlorophenyl)-N-[4-(2-furylcarbonylamino)phenyl]-furan-2-carboxamide

SMILES [?]:

c1cc(cc(c1)Cl)c2ccc(o2)C(=O)Nc3ccc(cc3)NC(=O)c4ccco4

InChi [?]:

InChI=1/C22H15ClN2O4/c23-15-4-1-3-14(13-15)18-10-11-20(29-18)22(27)25-17-8-6-16(7-9-17)24-21(26)19-5-2-12-28-19/h1-13H,(H,24,26)(H,25,27)

InChi Info:

AuxInfo=1/1/N:1,27,2,6,26,18,20,17,21,9,10,28,4,3,5,19,16,8,25,11,23,13,7,22,15,24,14,29,12/E:(6,7)(8,9)/rA:29nCCCCCCClCCCCOCONCCCCCCNCOCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s9;d10;s8s11;s11;d13;s13;s15;s16;d17;s18;d19;d16s20;s19;s22;d23;s23;d25;s26;d27;s25s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₁₅ClN₂O₄
All Atoms:	44
Heavy Atoms:	29
Chiral Atoms:	None

ZAP Information [?]

Total:	12.3515
Area:	642.979
Solvation:	-3.723
Coulombic:	-61.7727

Bond Count [?]

All:	32
Single:	20
Double:	12
Rotors:	7
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	3.52
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value