D442-0310 Screening compound: N-[3-(dimethylamino)propyl]-N-[(2,2-dimethyloxan-4-yl)methyl]furan-2-carboxamide

D442-0310 Screening compound: N-[3-(dimethylamino)propyl]-N-[(2,2-dimethyloxan-4-yl)methyl]furan-2-carboxamide
D442-0310 Screening compound: N-[3-(dimethylamino)propyl]-N-[(2,2-dimethyloxan-4-yl)methyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D442-0310
N-[3-(dimethylamino)propyl]-N-[(2,2-dimethyloxan-4-yl)methyl]furan-2-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D442-0310

Molecular Formula

C18H30N2O3 (C18 H30 N2 O3)

Compound Name

N-[3-(dimethylamino)propyl]-N-[(2,2-dimethyloxan-4-yl)methyl]furan-2-carboxamide

IUPAC name

N-[3-(dimethylamino)propyl]-N-[(22-dimethyloxan-4-yl)methyl]furan-2-carboxamide

SMILES

CC1(C)OCCC(CN(CCCN(C)C)C(c2ccco2)=O)C1

InChI

InChI=1S/C18H30N2O3/c1-18(2)13-15(8-12-23-18)14-20(10-6-9-19(3)4)17(21)16-7-5-11-22-16/h5,7,11,15H,6,8-10,12-14H2,1-4H3/t15-/m0/s1

InChI Key

FRBNYQPMSBVKEJ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD05671040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.296

Distribution Coefficient, logD

0.213

Water Solubility, LogSw

-2.45

Polar Surface Area

36.263

Acid Dissociation Constant (pKa)

25.66

Base Dissociation Constant (pKb)

9.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.22

D442-0310 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D442-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D442-0310?
Check Price and Availability of D442-0310, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D442-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D442-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D442-0310
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D442-0310 available by request