FQI1 50mg

CAT: 0628-A24232-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A24232-50Size:50 mg

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CAS Number

599151-35-6

Chemical Information

8-(2-ethoxyphenyl)-7,8-dihydro-(1,3)dioxolo(4,5-g)quinolin-6(5H)-one

blocks ability of late SV-40 factor to bind target promoters; structure in first source

CAS Number	599151-35-6
PubChem CID	656346
IUPAC Name	8-(2-ethoxyphenyl)-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]quinolin-6-one
Molecular Formula	C18H17NO4
Molecular Weight	311.3
XLogP	2.7
Topological Polar Surface Area	56.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	23
Formal Charge	0
Complexity	443

SMILES

CCOC1=CC=CC=C1C2CC(=O)NC3=CC4=C(C=C23)OCO4

InChI

InChI=1S/C18H17NO4/c1-2-21-15-6-4-3-5-11(15)12-8-18(20)19-14-9-17-16(7-13(12)14)22-10-23-17/h3-7,9,12H,2,8,10H2,1H3,(H,19,20)

InChIKey

YKSYGLXHLSPWLB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 599151-35-6

CID: 656346

Formula: C18H17NO4

MW: 311.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	311.3
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	311.11575802
Monoisotopic Mass	311.11575802
Topological Polar Surface Area	56.8 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	443
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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