C660-0841 Screening compound: 3,6-dimethyl-N-(2-methylpropyl)-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

C660-0841 Screening compound: 3,6-dimethyl-N-(2-methylpropyl)-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide
C660-0841 Screening compound: 3,6-dimethyl-N-(2-methylpropyl)-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0841
3,6-dimethyl-N-(2-methylpropyl)-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-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

C660-0841

Molecular Formula

C13H17N3O3 (C13 H17 N3 O3)

Compound Name

3,6-dimethyl-N-(2-methylpropyl)-4-oxo-3H,4H-furo[2,3-d]pyrimidine-5-carboxamide

IUPAC name

36-dimethyl-N-(2-methylpropyl)-4-oxo-3H4H-furo[23-d]pyrimidine-5-carboxamide

SMILES

CC(C)CNC(c1c(C)oc(N=CN2C)c1C2=O)=O

InChI

InChI=1S/C13H17N3O3/c1-7(2)5-14-11(17)9-8(3)19-12-10(9)13(18)16(4)6-15-12/h6-7H,5H2,1-4H3,(H,14,17)

InChI Key

NKCOGKPZMMHUQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10659880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.308

Distribution Coefficient, logD

0.308

Water Solubility, LogSw

-1.22

Polar Surface Area

58.393

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

C660-0841 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with C660-0841 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0841?
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What is the minimum amount of C660-0841 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0841
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0841
  • 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 C660-0841 available by request