V027-4890 Screening compound: N~1~-(tert-butyl)-N~3~-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-pyrrolidinedicarboxamide

V027-4890 Screening compound: N~1~-(tert-butyl)-N~3~-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-pyrrolidinedicarboxamide
V027-4890 Screening compound: N~1~-(tert-butyl)-N~3~-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-pyrrolidinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-4890
N~1~-(tert-butyl)-N~3~-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-pyrrolidinedicarboxamide

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

V027-4890

Molecular Formula

C21H31N3O4 (C21 H31 N3 O4)

Compound Name

N~1~-(tert-butyl)-N~3~-cyclopropyl-4-(2,4-dimethoxyphenyl)-1,3-pyrrolidinedicarboxamide

IUPAC name

n/a

SMILES

CC(C)(C)NC(N(CC1C(NC2CC2)=O)CC1c(ccc(OC)c1)c1OC)=O

InChI

InChI=1S/C21H31N3O4/c1-21(2,3)23-20(26)24-11-16(17(12-24)19(25)22-13-6-7-13)15-9-8-14(27-4)10-18(15)28-5/h8-10,13,16-17H,6-7,11-12H2,1-5H3,(H,22,25)(H,23,26)

InChI Key

MXRGMZSCILQDIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14262303

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.878

Distribution Coefficient, logD

2.878

Water Solubility, LogSw

-3.42

Polar Surface Area

65.730

Acid Dissociation Constant (pKa)

12.53

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

V027-4890 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V027-4890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-4890?
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What is the minimum amount of V027-4890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-4890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-4890
  • 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 V027-4890 available by request