P315-0645 Screening compound: 1-benzyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea

P315-0645 Screening compound: 1-benzyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea
P315-0645 Screening compound: 1-benzyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound P315-0645
1-benzyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea

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

P315-0645

Molecular Formula

C20H23N3O2 (C20 H23 N3 O2)

Compound Name

1-benzyl-3-[1-(3,4-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea

IUPAC name

1-benzyl-3-[1-(34-dimethylphenyl)-2-oxopyrrolidin-3-yl]urea

SMILES

Cc(cc1)c(C)cc1N(CCC1NC(NCc2ccccc2)=O)C1=O

InChI

InChI=1S/C20H23N3O2/c1-14-8-9-17(12-15(14)2)23-11-10-18(19(23)24)22-20(25)21-13-16-6-4-3-5-7-16/h3-9,12,18H,10-11,13H2,1-2H3,(H2,21,22,25)/t18-/m0/s1

InChI Key

ZEOCAPODOACVGG-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27572093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.000

Distribution Coefficient, logD

3.000

Water Solubility, LogSw

-3.27

Polar Surface Area

51.648

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

P315-0645 in Drug Discovery

Included in Screening Libraries

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

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with P315-0645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P315-0645?
Check Price and Availability of P315-0645, 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 P315-0645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P315-0645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P315-0645
  • 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 P315-0645 available by request