Win 58237 100mg

CAT: 0628-A20012-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0628-A20012-100Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

158001-76-4

Chemical Information

1-cyclopentyl-3-methyl-6-pyridin-4-yl-5H-pyrazolo[5,4-d]pyrimidin-4-one

CAS Number	158001-76-4
PubChem CID	135494251
IUPAC Name	1-cyclopentyl-3-methyl-6-pyridin-4-yl-5H-pyrazolo[5,4-d]pyrimidin-4-one
Molecular Formula	C16H17N5O
Molecular Weight	295.34
XLogP	1.5
Topological Polar Surface Area	72.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	22
Formal Charge	0
Complexity	467

SMILES

CC1=NN(C2=C1C(=O)NC(=N2)C3=CC=NC=C3)C4CCCC4

InChI

InChI=1S/C16H17N5O/c1-10-13-15(21(20-10)12-4-2-3-5-12)18-14(19-16(13)22)11-6-8-17-9-7-11/h6-9,12H,2-5H2,1H3,(H,18,19,22)

InChIKey

GODZWYONGRENHA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 158001-76-4

CID: 135494251

Formula: C16H17N5O

MW: 295.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	295.34
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	295.14331018
Monoisotopic Mass	295.14331018
Topological Polar Surface Area	72.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	467
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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