C470-0510 Screening compound: 2-{1,3-dimethyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetamide

C470-0510 Screening compound: 2-{1,3-dimethyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetamide
C470-0510 Screening compound: 2-{1,3-dimethyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C470-0510
2-{1,3-dimethyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetamide

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

C470-0510

Molecular Formula

C14H20N6O4 (C14 H20 N6 O4)

Compound Name

2-{1,3-dimethyl-8-[(morpholin-4-yl)methyl]-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetamide

IUPAC name

2-{13-dimethyl-8-[(morpholin-4-yl)methyl]-26-dioxo-2367-tetrahydro-1H-purin-7-yl}acetamide

SMILES

CN(c1c(C(N2C)=O)n(CC(N)=O)c(CN3CCOCC3)n1)C2=O

InChI

InChI=1S/C14H20N6O4/c1-17-12-11(13(22)18(2)14(17)23)20(7-9(15)21)10(16-12)8-19-3-5-24-6-4-19/h3-8H2,1-2H3,(H2,15,21)

InChI Key

HBZWCEJZXVFKLN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03087651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-1.170

Distribution Coefficient, logD

-1.170

Water Solubility, LogSw

0.18

Polar Surface Area

88.981

Acid Dissociation Constant (pKa)

15.23

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

C470-0510 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C470-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C470-0510?
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What is the minimum amount of C470-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C470-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C470-0510
  • 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 C470-0510 available by request