Y043-2501 Screening compound: 4-{[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]amino}butanoic acid

Y043-2501 Screening compound: 4-{[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]amino}butanoic acid
Y043-2501 Screening compound: 4-{[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]amino}butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-2501
4-{[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]amino}butanoic 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

Y043-2501

Molecular Formula

C16H18ClN3O3 (C16 H18 ClN3 O3)

Compound Name

4-{[(6-chloro-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)carbonyl]amino}butanoic acid

IUPAC name

4-({6-chloro-1H2H3H4H9H-pyrido[34-b]indole-2-carbonyl}amino)butanoic acid

SMILES

OC(CCCNC(N(CC1)Cc2c1c(cc(cc1)Cl)c1[nH]2)=O)=O

InChI

InChI=1S/C16H18ClN3O3/c17-10-3-4-13-12(8-10)11-5-7-20(9-14(11)19-13)16(23)18-6-1-2-15(21)22/h3-4,8,19H,1-2,5-7,9H2,(H,18,23)(H,21,22)

InChI Key

GHMZBEKHUPNBSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09858472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.610

Distribution Coefficient, logD

-1.211

Water Solubility, LogSw

-2.59

Polar Surface Area

66.038

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

Y043-2501 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y043-2501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-2501?
Check Price and Availability of Y043-2501, 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 Y043-2501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-2501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-2501
  • 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 Y043-2501 available by request