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Chemical ID: 7707715

Cc1cccc(c1)NC(=O)C(=O)NN=Cc2cc(ccc2OC(=O)c3ccc(cc3)Cl)Br

Chemical ID:

7707715

Name [?]:

None

SMILES [?]:

Cc1cccc(c1)NC(=O)C(=O)NN=Cc2cc(ccc2OC(=O)c3ccc(cc3)Cl)Br

InChi [?]:

InChI=1/C23H17BrClN3O4/c1-14-3-2-4-19(11-14)27-21(29)22(30)28-26-13-16-12-17(24)7-10-20(16)32-23(31)15-5-8-18(25)9-6-15/h2-13H,1H3,(H,27,29)(H,28,30)

InChi Info:

AuxInfo=1/1/N:1,4,3,5,26,30,19,27,29,20,7,17,15,2,25,16,18,28,6,21,9,11,23,32,31,14,8,13,10,12,24,22/E:(5,6)(8,9)/rA:32nCCCCCCCNCOCONNCCCCCCCOCOCCCCCCClBr/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;d11;s11;s13;w14;s15;s16;d17;s18;d19;d16s20;s21;s22;d23;s23;s25;d26;s27;d28;d25s29;s28;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₁₇BrClN₃O₄
All Atoms:	49
Heavy Atoms:	32
Chiral Atoms:	None

ZAP Information [?]

Total:	13.2297
Area:	680.005
Solvation:	-3.77039
Coulombic:	-65.1792

Bond Count [?]

All:	34
Single:	21
Double:	13
Rotors:	9
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	6.38
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