Darolutamide-D4

CAT: 1596-AR-D08003-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-D08003-02Size:25 Units

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CAS Number

2484757-20-0

Synonyms

N- ((S) -1- (3- (3-chloro-4-cyanophenyl) -1H-pyrazol-1-yl) propan-2-yl) -5- (1-hydroxyethyl-1,2,2,2-d4) -1H-pyrazole-3-carboxamide; Nubeqa D4; ODM 201 D4

Molecular Formula

C19H15D4ClN6O2

Molecular Weight

402.88

API Name

Darolutamide

Chemical Information

Darolutamide-d4

CAS Number	2484757-20-0
PubChem CID	162427113
IUPAC Name	N-[(2S)-1-[3-(3-chloro-4-cyanophenyl)pyrazol-1-yl]propan-2-yl]-5-(1,2,2,2-tetradeuterio-1-hydroxyethyl)-1H-pyrazole-3-carboxamide
Molecular Formula	C19H19ClN6O2
Molecular Weight	402.9
XLogP	1.8
Topological Polar Surface Area	120
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	28
Formal Charge	0
Complexity	598

SMILES

[2H]C([2H])([2H])C([2H])(C1=CC(=NN1)C(=O)N[C@@H](C)CN2C=CC(=N2)C3=CC(=C(C=C3)C#N)Cl)O

InChI

InChI=1S/C19H19ClN6O2/c1-11(22-19(28)18-8-17(12(2)27)23-24-18)10-26-6-5-16(25-26)13-3-4-14(9-21)15(20)7-13/h3-8,11-12,27H,10H2,1-2H3,(H,22,28)(H,23,24)/t11-,12?/m0/s1/i2D3,12D

InChIKey

BLIJXOOIHRSQRB-ZTXDNGCXSA-N

Chemical Structure

2D Structure

CAS: 2484757-20-0

CID: 162427113

Formula: C19H19ClN6O2

MW: 402.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	402.9
XLogP3	1.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	402.1509085
Monoisotopic Mass	402.1509085
Topological Polar Surface Area	120 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	598
Isotope Atom Count	4
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
AR-D06061-01	Darolutamide
AR-D08045-01	Darolutamide Fragment
AR-D06496-01	N-Nitroso Darolutamide
AR-D06062-01	Darolutamide d-4
AR-D08002-01	Darolutamide Acetyl Impurity
AR-D08046-01	Darolutamide Amino impurity
AR-D08027-01	Darolutamide Impurity 11
AR-D08024-01	Darolutamide Amide Impurity
AR-D08023-01	Darolutamide Despyrazol Impurity
AR-D06499-01	Darolutamide Impurity 7

Alternative Products

Catalog	Name
TMIH-0176-01	Darolutamide-d4
TRC-D477711-25MG	Darolutamide D4
CS-O-52734	Darolutamide-d4 (ethyl-1,2,2,2-d4)
FD161413-01	Darolutamide
TRC-D421290-50MG	Darolutamide-Glu
CS-O-44799	Darolutamide-d6
HY-16985R-01	Darolutamide (Standard)
RM-D800004-01	Darolutamide Impurity 4
RM-D800030-01	Darolutamide Impurity 30
RM-D800016-01	Darolutamide Impurity 16

Darolutamide-D4

Chemical Information

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