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Chemical ID: 7533765

C=CCN1C(=O)c2c(c(=O)c3cc(ccc3o2)Cl)C14c5ccccc5N(C4=O)Cc6ccccc6

Chemical ID:

7533765

Name [?]:

None

SMILES [?]:

C=CCN1C(=O)c2c(c(=O)c3cc(ccc3o2)Cl)C14c5ccccc5N(C4=O)Cc6ccccc6

InChi [?]:

InChI=1/C28H19ClN2O4/c1-2-14-31-26(33)25-23(24(32)19-15-18(29)12-13-22(19)35-25)28(31)20-10-6-7-11-21(20)30(27(28)34)16-17-8-4-3-5-9-17/h2-13,15H,1,14,16H2

InChi Info:

AuxInfo=1/0/N:1,2,33,32,34,22,23,31,35,21,24,14,15,3,12,29,30,13,11,20,25,16,8,9,7,5,27,19,18,26,4,10,6,28,17/E:(4,5)(8,9)/rA:35cCCCNCOCCCOCCCCCCOClCCCCCCCNCOCCCCCCC/rB:d1;s2;s3;s4;d5;s5;d7;s8;d9;s9;s11;d12;s13;d14;d11s15;s7s16;s13;s4s8;s19;s20;d21;s22;d23;d20s24;s25;s19s26;d27;s26;s29;s30;d31;s32;d33;d30s34;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₈H₁₉ClN₂O₄
All Atoms:	54
Heavy Atoms:	35
Chiral Atoms:	None

ZAP Information [?]

Total:	12.2634
Area:	656.707
Solvation:	-4.15424
Coulombic:	-54.8869

Bond Count [?]

All:	40
Single:	26
Double:	14
Rotors:	4
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	4.48
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