5701-0282 Screening compound: 5-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-5-oxopentanoic acid

5701-0282 Screening compound: 5-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-5-oxopentanoic acid
5701-0282 Screening compound: 5-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-5-oxopentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5701-0282
5-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-5-oxopentanoic acid

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

5701-0282

Molecular Formula

C15H15NO5 (C15 H15 NO5)

Compound Name

5-[(4-methyl-2-oxo-2H-chromen-7-yl)amino]-5-oxopentanoic acid

IUPAC name

4-[(4-methyl-2-oxo-2H-chromen-7-yl)carbamoyl]butanoic acid

SMILES

CC(c(ccc(NC(CCCC(O)=O)=O)c1)c1O1)=CC1=O

InChI

InChI=1S/C15H15NO5/c1-9-7-15(20)21-12-8-10(5-6-11(9)12)16-13(17)3-2-4-14(18)19/h5-8H,2-4H2,1H3,(H,16,17)(H,18,19)

InChI Key

VFSSPFPKIUZLKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.792

Distribution Coefficient, logD

-1.805

Water Solubility, LogSw

-2.21

Polar Surface Area

72.179

Acid Dissociation Constant (pKa)

4.80

Base Dissociation Constant (pKb)

-3.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.67

5701-0282 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

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

Human Transcription Factors Annotated Library (5098 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with 5701-0282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5701-0282?
Check Price and Availability of 5701-0282, 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 5701-0282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5701-0282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5701-0282
  • 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 5701-0282 available by request