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Chemical ID: 7167154

Cc1cc(n(n1)Cc2ccc(o2)c3nc4c5c(c(sc5ncn4n3)C)c6ccccc6)C

Chemical ID:

7167154

Name [?]:

None

SMILES [?]:

Cc1cc(n(n1)Cc2ccc(o2)c3nc4c5c(c(sc5ncn4n3)C)c6ccccc6)C

InChi [?]:

InChI=1/C24H20N6OS/c1-14-11-15(2)29(27-14)12-18-9-10-19(31-18)22-26-23-21-20(17-7-5-4-6-8-17)16(3)32-24(21)25-13-30(23)28-22/h4-11,13H,12H2,1-3H3

InChi Info:

AuxInfo=1/0/N:1,32,25,29,28,30,27,31,9,10,3,7,22,2,4,18,26,8,11,17,16,13,15,20,21,14,6,24,5,23,12,19/E:(5,6)(7,8)/rA:32nCCCCNNCCCCCOCNCCCCSCNCNNCCCCCCCC/rB:s1;s2;d3;s4;d2s5;s5;s7;d8;s9;d10;s8s11;s11;s13;d14;s15;s16;d17;s18;d16s19;s20;d21;s15s22;d13s23;s18;s17;s26;d27;s28;d29;d26s30;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₀N₆OS
All Atoms:	52
Heavy Atoms:	32
Chiral Atoms:	None

ZAP Information [?]

Total:	12.1281
Area:	629.33
Solvation:	-3.60512
Coulombic:	-30.7469

Bond Count [?]

All:	37
Single:	25
Double:	12
Rotors:	4
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	3.66
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