TG101209

CAT: 0498-bs-7127C-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0498-bs-7127C-02Size:10 mg

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

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CAS Number

936091-14-4

Conjugation

Unconjugated

Purity

Buffer

Powder

Solubility

Soluble in DMSO, not in water

Smiles

CN1CCN(CC1)C1C=CC(=CC=1)NC1N=C(NC2C=C(C=CC=2)S(=O)(=O)NC(C)(C)C)C(C)=CN=1

Molecular Formula

C26 H35 N7 O2 S

Molecular Weight

509.67

InChI

InChI=1S/C26H35N7O2S/c1-19-18-27-25 (29-20-9-11-22 (12-10-20) 33-15-13-32 (5) 14-16-33) 30-24 (19) 28-21-7-6-8-23 (17-21) 36 (34,35) 31-26 (2,3) 4/h6-12,17-18,31H,13-16H2,1-5H3, (H2,27,28,29,30)

Storage Conditions

Store in dry, dark place at -20C for 1 year.

Shelf Life

1 year

Appearance

Solid Power.

Chemical Information

TG101209

TG101209 is a member of the class of pyrimidines that is 5-methylpyrimidine-2,4-diamine in which the amino group at position 2 is substituted by a p-(4-methylpiperazin-1-yl)phenyl group, while that at position 4 is substituted by a m-(tert-butylsulfamoyl)phenyl group. A Janus kinase 2 (JAK2) inhibitor. It has a role as an antineoplastic agent, an apoptosis inducer and an EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor. It is a sulfonamide, a member of pyrimidines, a N-alkylpiperazine, a N-arylpiperazine and a secondary amino compound.

CAS Number	936091-14-4
PubChem CID	16722832
IUPAC Name	N-tert-butyl-3-[[5-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]benzenesulfonamide
Molecular Formula	C26H35N7O2S
Molecular Weight	509.7
XLogP	4.2
Topological Polar Surface Area	111
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	8
Heavy Atom Count	36
Formal Charge	0
Complexity	783

SMILES

CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C26H35N7O2S/c1-19-18-27-25(29-20-9-11-22(12-10-20)33-15-13-32(5)14-16-33)30-24(19)28-21-7-6-8-23(17-21)36(34,35)31-26(2,3)4/h6-12,17-18,31H,13-16H2,1-5H3,(H2,27,28,29,30)

InChIKey

JVDOKQYTTYUYDV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 936091-14-4

CID: 16722832

Formula: C26H35N7O2S

MW: 509.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	509.7
XLogP3	4.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	8
Exact Mass	509.25729456
Monoisotopic Mass	509.25729456
Topological Polar Surface Area	111 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	783
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

Alternative Products

Catalog	Name
T3065-01	TG101209

TG101209

Chemical Information

Alternative Products

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