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Chemical ID: 7703429

CCOc1ccc(cc1)C(=O)Oc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc(cc3Cl)Cl

Chemical ID:

7703429

Name [?]:

None

SMILES [?]:

CCOc1ccc(cc1)C(=O)Oc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc(cc3Cl)Cl

InChi [?]:

InChI=1/C25H22Cl2N2O5/c1-3-32-20-11-6-18(7-12-20)25(31)34-21-9-4-17(5-10-21)15-28-29-24(30)16(2)33-23-13-8-19(26)14-22(23)27/h4-16H,3H2,1-2H3,(H,29,30)

InChi Info:

AuxInfo=1/1/N:1,25,2,15,17,6,8,29,14,18,5,9,28,31,19,24,16,7,30,4,13,32,27,22,10,34,33,20,21,23,11,3,26,12/E:(4,5)(6,7)(9,10)(11,12)/rA:34cCCOCCCCCCCOOCCCCCCCNNCOCCOCCCCCCClCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;s10;s12;s13;d14;s15;d16;d13s17;s16;w19;s20;s21;d22;s22;s24;s24;s26;s27;d28;s29;d30;d27s31;s32;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₅H₂₂Cl₂N₂O₅
All Atoms:	56
Heavy Atoms:	34
Chiral Atoms:	None

ZAP Information [?]

Total:	11.483
Area:	760.333
Solvation:	-7.52535
Coulombic:	-54.1094

Bond Count [?]

All:	36
Single:	24
Double:	12
Rotors:	11
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	7.29
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