V004-2815 Screening compound: N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]-3-phenylpropanamide

V004-2815 Screening compound: N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]-3-phenylpropanamide
V004-2815 Screening compound: N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2815
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]-3-phenylpropanamide

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

V004-2815

Molecular Formula

C35H41N5O4 (C35 H41 N5 O4)

Compound Name

N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1H,2H,3H,4H,5H,6H,7H-pyrrolo[3,4-d]pyrimidin-6-yl]-3-phenylpropanamide

IUPAC name

N-[3-(dimethylamino)-22-dimethylpropyl]-2-[1-methyl-25-dioxo-4-(3-phenoxyphenyl)-1H2H3H4H5H6H7H-pyrrolo[34-d]pyrimidin-6-yl]-3-phenylpropanamide

SMILES

CC(C)(CNC(C(Cc1ccccc1)N(CC(N1C)=C2C(c3cc(Oc4ccccc4)ccc3)NC1=O)C2=O)=O)CN(C)C

InChI

InChI=1S/C35H41N5O4/c1-35(2,23-38(3)4)22-36-32(41)28(19-24-13-8-6-9-14-24)40-21-29-30(33(40)42)31(37-34(43)39(29)5)25-15-12-18-27(20-25)44-26-16-10-7-11-17-26/h6-18,20,28,31H,19,21-23H2,1-5H3,(H,36,41)(H,37,43)

InChI Key

UEAXQQIFDNSLHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19936273

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

595.74

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.311

Distribution Coefficient, logD

1.802

Water Solubility, LogSw

-4.46

Polar Surface Area

78.913

Acid Dissociation Constant (pKa)

8.89

Base Dissociation Constant (pKb)

9.91

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.30

V004-2815 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V004-2815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2815?
Check Price and Availability of V004-2815, 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 V004-2815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2815
  • 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 V004-2815 available by request