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NAcM-OPT

CAT: 0013-GTR19162812-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162812-01Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NAcM-OPT is a specific, reversible small molecule inhibitor targeting N-Acetyl-UBE2M interaction with DCN1 with IC50 of 79 nM in TR-FRET assays; also inhibits DCN2, but has no activity against DCN3, DCN4, or DCN5; inhibits NEDD8 ligation in vitro and in cells, and suppress anchorage-independent growth of a cell line with DCN1 amplification.
CAS Number
2089293-61-6
Product Name Alternative
NAcM-OPT | NAcM OPT | NAcMOPT
Purity
>98% (HPLC)
Solubility
DMSO: 100 mg/mL, 230.20 mM; Water: Insoluble (< 1 mg/ml refers to the product slightly soluble or insoluble)
Smiles
O=C (NC1=CC=C (Cl) C (Cl) =C1) N (CC2=CC=CC=C2) C3CCN (CCCC) CC3
Molecular Formula
C23H29Cl2N3O
Molecular Weight
434.405
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
1-benzyl-1- (1-butylpiperidin-4-yl) -3- (3,4-dichlorophenyl) urea

Chemical Information

NAcM-OPT

1-Benzyl-1-(1-butyl-4-piperidinyl)-3-(3,4-dichlorophenyl)urea is a member of ureas.

CAS Number2089293-61-6
PubChem CID126711307
IUPAC Name1-benzyl-1-(1-butylpiperidin-4-yl)-3-(3,4-dichlorophenyl)urea
Molecular FormulaC23H29Cl2N3O
Molecular Weight434.4
XLogP5.7
Topological Polar Surface Area35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity493
SMILES
CCCCN1CCC(CC1)N(CC2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C23H29Cl2N3O/c1-2-3-13-27-14-11-20(12-15-27)28(17-18-7-5-4-6-8-18)23(29)26-19-9-10-21(24)22(25)16-19/h4-10,16,20H,2-3,11-15,17H2,1H3,(H,26,29)
InChIKey
VPHJABWIKCBGMC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of NAcM-OPT
CAS: 2089293-61-6
CID: 126711307
Formula: C23H29Cl2N3O
MW: 434.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight434.4
XLogP35.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass433.1687679
Monoisotopic Mass433.1687679
Topological Polar Surface Area35.6 Ų
Heavy Atom Count29
Formal Charge0
Complexity493
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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BA7382-10NAcM-OPT
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A19646-5NAcM-OPT 5mg
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