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Chemical ID: 3967310

Chemical ID:

3967310

Name [?]:

2-morpholino-8-phenyl-chromen-4-one

SMILES [?]:

c1ccc(cc1)c2cccc3c2oc(cc3=O)N4CCOCC4

InChi [?]:

InChI=1/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2

InChi Info:

AuxInfo=1/0/N:1,2,6,9,3,5,8,10,19,23,20,22,15,4,7,11,16,14,12,18,17,21,13/E:(2,3)(5,6)(9,10)(11,12)/rA:23nCCCCCCCCCCCCOCCCONCCOCC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s12;s13;d14;s11s15;d16;s14;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₁₇NO₃
All Atoms:	23
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	8.35311
Area:	476.866
Solvation:	-3.56855
Coulombic:	-33.2888

Bond Count [?]

All:	26
Single:	18
Double:	8
Rotors:	2
Chiral:	0
Rigid Segments:	3

Chemical Properties

Molecular Weight:	307.343
H-Bond Donors:	0
H-Bond Acceptors:	3
XLogP:	3.92
LogP (Chemaxon):	3.72

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value