Products for Research Use Only
RegisterLogin

ND-646

CAT: 1410-M22091-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M22091-02Size:1 mL x 10 mM in DMSO
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
ND-646 is an orally bioavailable and allosteric inhibitor of the ACC enzymes ACC1 and ACC2 (IC50s of 3.5 nM and 4.1 nM for recombinant hACC1 and hACC2, respectively) ND-646-an allosteric inhibitor of the ACC enzymes. ACC1 and ACC2 that prevents ACC subunit dimerization-to suppress fatty acid synthesis in vitro and in vivo.
CAS Number
1434639-57-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
568.64
Molecular Formula
C28H32N4O7S
Notes
Research use only, not for human use.
Receptor
ACC

Chemical Information

2-[1-[(2~{r})-2-(2-Methoxyphenyl)-2-(Oxan-4-Yloxy)ethyl]-5-Methyl-6-(1,3-Oxazol-2-Yl)-2,4-Bis(Oxidanylidene)thieno[2,3-D]pyrimidin-3-Yl]-2-Methyl-Propanamide
CAS Number1434639-57-2
PubChem CID71570560
IUPAC Name2-[1-[(2R)-2-(2-methoxyphenyl)-2-(oxan-4-yloxy)ethyl]-5-methyl-6-(1,3-oxazol-2-yl)-2,4-dioxothieno[2,3-d]pyrimidin-3-yl]-2-methylpropanamide
Molecular FormulaC28H32N4O7S
Molecular Weight568.6
XLogP2.6
Topological Polar Surface Area166
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Heavy Atom Count40
Formal Charge0
Complexity948
SMILES
CC1=C(SC2=C1C(=O)N(C(=O)N2C[C@@H](C3=CC=CC=C3OC)OC4CCOCC4)C(C)(C)C(=O)N)C5=NC=CO5
InChI
InChI=1S/C28H32N4O7S/c1-16-21-24(33)32(28(2,3)26(29)34)27(35)31(25(21)40-22(16)23-30-11-14-38-23)15-20(39-17-9-12-37-13-10-17)18-7-5-6-8-19(18)36-4/h5-8,11,14,17,20H,9-10,12-13,15H2,1-4H3,(H2,29,34)/t20-/m0/s1
InChIKey
HSRWXLIYNCKHRZ-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of 2-[1-[(2~{r})-2-(2-Methoxyphenyl)-2-(Oxan-4-Yloxy)ethyl]-5-Methyl-6-(1,3-Oxazol-2-Yl)-2,4-Bis(Oxidanylidene)thieno[2,3-D]pyrimidin-3-Yl]-2-Methyl-Propanamide
CAS: 1434639-57-2
CID: 71570560
Formula: C28H32N4O7S
MW: 568.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight568.6
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass568.19917055
Monoisotopic Mass568.19917055
Topological Polar Surface Area166 Ų
Heavy Atom Count40
Formal Charge0
Complexity948
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
M11847-01ND-654
M36991-01ND-011992
M34343-01ND-322 HCl

Alternative Products

CatalogName
406951ND-646
A20079-25ND-646 25mg
A20079-100ND-646 100mg
A20079-50ND-646 50mg
A20079-10ND-646 10mg
A20079-5ND-646 5mg
A20079-1ND-646 1mg
A20079-10mM-DND-646 10mM * 1mL in DMSO
A135334MOR101 Biosimilar (Monoclonal, Fab-nd-nd)
A135120Pexelizumab Biosimilar (Monoclonal, scFv-nd-nd)

Popular Products