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Chemical ID: 7703708

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl

Chemical ID:

7703708

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl

InChi [?]:

InChI=1/C23H21ClN2O3/c1-17-2-4-19(5-3-17)15-28-21-10-6-18(7-11-21)14-25-26-23(27)16-29-22-12-8-20(24)9-13-22/h2-14H,15-16H2,1H3,(H,26,27)

InChi Info:

AuxInfo=1/1/N:1,3,7,4,6,12,14,25,27,11,15,24,28,16,8,21,2,13,5,26,10,23,19,29,17,18,20,9,22/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:29nCCCCCCCCOCCCCCCCNNCOCOCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;w16;s17;s18;d19;s19;s21;s22;s23;d24;s25;d26;d23s27;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₁ClN₂O₃
All Atoms:	50
Heavy Atoms:	29
Chiral Atoms:	None

ZAP Information [?]

Total:	9.83383
Area:	688.654
Solvation:	-7.38251
Coulombic:	-34.7233

Bond Count [?]

All:	31
Single:	20
Double:	11
Rotors:	9
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	6.36
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