6-Desfluoro-6-Hydroxy Risperidone

CAT: 1596-AR-R01689-04Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R01689-04Size:100 Units

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CAS Number

106266-11-9

Synonyms

3- (2- (4- (6-hydroxybenzo[d]isoxazol-3-yl) piperidin-1-yl) ethyl) -2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one;6,7,8,9-Tetrahydro-3-[2-[4- (6-hydroxy-1,2-benzisoxazol-3-yl) -1-piperidinyl]ethyl]-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one; ;6-Desfluoro-6-hydroxy Risperidone

Molecular Formula

C23H28N4O3

Molecular Weight

408.5

API Name

Risperidone

Chemical Information

6-Desfluoro-6-hydroxy Risperidone

CAS Number	106266-11-9
PubChem CID	135688055
IUPAC Name	3-[2-[4-(6-hydroxy-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
Molecular Formula	C23H28N4O3
Molecular Weight	408.5
XLogP	2.3
Topological Polar Surface Area	82.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	30
Formal Charge	0
Complexity	728

SMILES

CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)O

InChI

InChI=1S/C23H28N4O3/c1-15-18(23(29)27-10-3-2-4-21(27)24-15)9-13-26-11-7-16(8-12-26)22-19-6-5-17(28)14-20(19)30-25-22/h5-6,14,16,28H,2-4,7-13H2,1H3

InChIKey

KMZACMPMNDRKFH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 106266-11-9

CID: 135688055

Formula: C23H28N4O3

MW: 408.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	408.5
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	408.21614077
Monoisotopic Mass	408.21614077
Topological Polar Surface Area	82.2 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	728
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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Alternative Products

Catalog	Name
008419	6-Desfluoro-6-hydroxy Risperidone
sc-499492	6-Desfluoro-6-methoxy risperidone
271585-01	Desfluoro risperidone
TRC-M326330-50MG	6-Methyl Risperidone
TRC-D455630-100MG	3,6-Dihydro Risperidone
279205-01	7-Hydroxy risperidone
CS-T-56444	7-Hydroxy Risperidone-d4
TRC-H953355-10MG	(R)-9-Hydroxy Risperidone
TRC-H953360-1MG	(S)-9-Hydroxy Risperidone
sc-488626	(S) -9-Hydroxy risperidone

6-Desfluoro-6-Hydroxy Risperidone

Chemical Information

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