V017-9048 Screening compound: 6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidine-2,5-dione

V017-9048 Screening compound: 6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidine-2,5-dione
V017-9048 Screening compound: 6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-9048
6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidine-2,5-dione

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

V017-9048

Molecular Formula

C17H21N3O4 (C17 H21 N3 O4)

Compound Name

6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidine-2,5-dione

IUPAC name

6-(2-methoxyethyl)-4-(4-methoxyphenyl)-1-methyl-1H2H3H4H5H6H7H-pyrrolo[34-d]pyrimidine-25-dione

SMILES

CN(C(CN1CCOC)=C(C(c(cc2)ccc2OC)N2)C1=O)C2=O

InChI

InChI=1S/C17H21N3O4/c1-19-13-10-20(8-9-23-2)16(21)14(13)15(18-17(19)22)11-4-6-12(24-3)7-5-11/h4-7,15H,8-10H2,1-3H3,(H,18,22)/t15-/m0/s1

InChI Key

LNRVCTNXUXNONZ-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.709

Distribution Coefficient, logD

0.704

Water Solubility, LogSw

-1.82

Polar Surface Area

60.638

Acid Dissociation Constant (pKa)

9.39

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with V017-9048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-9048?
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What is the minimum amount of V017-9048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-9048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-9048
  • 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 V017-9048 available by request