Products for Research Use Only
RegisterLogin

BIX01294 (hydrochloride hydrate)

CAT: 0931-T35567-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T35567-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1808255-64-2
Target
Autophagy, Apoptosis, Histone Methyltransferase, Others
Related Pathways
Others, Chromatin/Epigenetic, Autophagy, Apoptosis
Bioactivity
The methylation of lysine residues on histones plays a central role in determining euchromatin structure and gene expression. The histone methyltransferase (HMTase) G9a can mono- or dimethylate lysine 9 on histone 3 (H3), contributing to early embryogenesis, genomic imprinting, and lymphocyte development. BIX01294 (hydrochloride hydrate) is a selective inhibitor of G9a HMTase (IC50 = 1.7 μM) . It less effectively inhibits the HMTase G9a-like protein (GLP; IC50 = 38 μM) and has no effect on other known HMTases. BIX01294 has been used in combination with the calcium channel activator BayK8644 to facilitate the generation of induced pluripotent stem cells from somatic cells in vitro.
Smiles
O.Cl.Cl.Cl.COc1cc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC)N1CCCN(C)CC1
Molecular Formula
C28H43Cl3N6O3
Molecular Weight
618.04
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

BIX01294 (hydrochloride hydrate)
CAS Number1808255-64-2
PubChem CID73357457
IUPAC NameN-(1-benzylpiperidin-4-yl)-6,7-dimethoxy-2-(4-methyl-1,4-diazepan-1-yl)quinazolin-4-amine;hydrate;trihydrochloride
Molecular FormulaC28H43Cl3N6O3
Molecular Weight618.0
Topological Polar Surface Area67
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count40
Formal Charge0
Complexity656
SMILES
CN1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)NC4CCN(CC4)CC5=CC=CC=C5)OC)OC.O.Cl.Cl.Cl
InChI
InChI=1S/C28H38N6O2.3ClH.H2O/c1-32-12-7-13-34(17-16-32)28-30-24-19-26(36-3)25(35-2)18-23(24)27(31-28)29-22-10-14-33(15-11-22)20-21-8-5-4-6-9-21;;;;/h4-6,8-9,18-19,22H,7,10-17,20H2,1-3H3,(H,29,30,31);3*1H;1H2
InChIKey
BZOWJAYUMMHCDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of BIX01294 (hydrochloride hydrate)
CAS: 1808255-64-2
CID: 73357457
Formula: C28H43Cl3N6O3
MW: 618.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight618.0
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass616.246222
Monoisotopic Mass616.246222
Topological Polar Surface Area67 Ų
Heavy Atom Count40
Formal Charge0
Complexity656
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes

Related Products

CatalogName
T4548-01Procaterol hydrochloride hydrate
T8385-01Metoclopramide hydrochloride hydrate
T63505-01Tivozanib hydrochloride hydrate
T63105-01Topotecan hydrochloride hydrate
T81445-01PKRA83 hydrochloride hydrate
TSH-00329-01TETA hydrochloride hydrate
T69628-01Iptacopan hydrochloride hydrate
T69002-01Zimeldine hydrochloride hydrate
TSH-00545-01TETA (hydrochloride hydrate)
TQ0304-01Metixene hydrochloride hydrate

Alternative Products

CatalogName
27220BIX01294 (hydrochloride hydrate)
sc-293525BIX01294 hydrochloride
C5039-5000Quinacrine (hydrochloride hydrate)
A9916-100Fedratinib hydrochloride hydrate
B8793-10(−)-Apomorphine (hydrochloride hydrate)
HY-13567ABendamustine (hydrochloride hydrate)
FA61507-01Metoclopramide hydrochloride hydrate
FA34819Adenine hydrochloride hydrate
HY-147056APKRA83 (hydrochloride hydrate)
HY-120081A-01Metixene (hydrochloride hydrate)

Popular Products