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Chemical ID: 7703763

Cc1ccc2c(c1)nc([nH]2)c3ccc(cc3)NC(=O)Cc4ccc(cc4)Cl

Chemical ID:

7703763

Name [?]:

None

SMILES [?]:

Cc1ccc2c(c1)nc([nH]2)c3ccc(cc3)NC(=O)Cc4ccc(cc4)Cl

InChi [?]:

InChI=1/C22H18ClN3O/c1-14-2-11-19-20(12-14)26-22(25-19)16-5-9-18(10-6-16)24-21(27)13-15-3-7-17(23)8-4-15/h2-12H,13H2,1H3,(H,24,27)(H,25,26)

InChi Info:

AuxInfo=1/1/N:1,3,22,26,12,16,23,25,13,15,4,7,20,2,21,11,24,14,5,6,18,9,27,17,10,8,19/E:(3,4)(5,6)(7,8)(9,10)/rA:27nCCCCCCCNCNCCCCCCNCOCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s5s9;s9;s11;d12;s13;d14;d11s15;s14;s17;d18;s18;s20;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₁₈ClN₃O
All Atoms:	45
Heavy Atoms:	27
Chiral Atoms:	None

ZAP Information [?]

Total:	11.9329
Area:	602.679
Solvation:	-3.13406
Coulombic:	-39.1508

Bond Count [?]

All:	30
Single:	19
Double:	11
Rotors:	5
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.11
LogP (Chemaxon):	None

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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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