1800-0129 Screening compound: 6-[(4-chlorophenyl)formamido]hexanoic acid

1800-0129 Screening compound: 6-[(4-chlorophenyl)formamido]hexanoic acid
1800-0129 Screening compound: 6-[(4-chlorophenyl)formamido]hexanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1800-0129
6-[(4-chlorophenyl)formamido]hexanoic 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

1800-0129

Molecular Formula

C13H16ClNO3 (C13 H16 ClNO3)

Compound Name

6-[(4-chlorophenyl)formamido]hexanoic acid

IUPAC name

6-[(4-chlorophenyl)formamido]hexanoic acid

SMILES

OC(CCCCCNC(c(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C13H16ClNO3/c14-11-7-5-10(6-8-11)13(18)15-9-3-1-2-4-12(16)17/h5-8H,1-4,9H2,(H,15,18)(H,16,17)

InChI Key

LVVXUQMNFZJIBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00554093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.73

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.828

Distribution Coefficient, logD

-1.001

Water Solubility, LogSw

-2.69

Polar Surface Area

53.149

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

1800-0129 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Pool

References: we are preparing a list of scientific research reports with 1800-0129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1800-0129?
Check Price and Availability of 1800-0129, 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 1800-0129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1800-0129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1800-0129
  • 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 1800-0129 available by request