G545-0282 Screening compound: 3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide

G545-0282 Screening compound: 3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide
G545-0282 Screening compound: 3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G545-0282
3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide

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

G545-0282

Molecular Formula

C27H30N4O4 (C27 H30 N4 O4)

Compound Name

3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide

IUPAC name

3-{[(4-methoxyphenyl)carbamoyl]amino}-N-[(4-methoxyphenyl)methyl]-4-(pyrrolidin-1-yl)benzamide

SMILES

COc1ccc(CNC(c(cc2)cc(NC(Nc(cc3)ccc3OC)=O)c2N2CCCC2)=O)cc1

InChI

InChI=1S/C27H30N4O4/c1-34-22-10-5-19(6-11-22)18-28-26(32)20-7-14-25(31-15-3-4-16-31)24(17-20)30-27(33)29-21-8-12-23(35-2)13-9-21/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,28,32)(H2,29,30,33)

InChI Key

QDEQZNFZUHEISF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15018682

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.957

Distribution Coefficient, logD

4.956

Water Solubility, LogSw

-4.64

Polar Surface Area

74.862

Acid Dissociation Constant (pKa)

10.40

Base Dissociation Constant (pKb)

8.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

G545-0282 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Proline Kinase Library (2105 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G545-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G545-0282?
Check Price and Availability of G545-0282, 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 G545-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G545-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G545-0282
  • 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 G545-0282 available by request