V027-8328 Screening compound: 3,3-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one

V027-8328 Screening compound: 3,3-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one
V027-8328 Screening compound: 3,3-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-8328
3,3-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one

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

V027-8328

Molecular Formula

C21H30N2O2 (C21 H30 N2 O2)

Compound Name

3,3-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one

IUPAC name

33-dimethyl-1-[3-phenyl-4-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one

SMILES

CC(C)(C)CC(N(CC1C(N2CCCC2)=O)CC1c1ccccc1)=O

InChI

InChI=1S/C21H30N2O2/c1-21(2,3)13-19(24)23-14-17(16-9-5-4-6-10-16)18(15-23)20(25)22-11-7-8-12-22/h4-6,9-10,17-18H,7-8,11-15H2,1-3H3

InChI Key

NLIXDXNHXSZITD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826662

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.671

Distribution Coefficient, logD

3.671

Water Solubility, LogSw

-3.80

Polar Surface Area

33.606

Acid Dissociation Constant (pKa)

21.25

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

V027-8328 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Soluble Diversity Library (15920 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V027-8328 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-8328?
Check Price and Availability of V027-8328, 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 V027-8328 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-8328
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-8328
  • 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 V027-8328 available by request