1309-2097 Screening compound: (2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide

1309-2097 Screening compound: (2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide
1309-2097 Screening compound: (2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1309-2097
(2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide

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

1309-2097

Molecular Formula

C18H19ClN2O4 (C18 H19 ClN2 O4)

Compound Name

(2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide

IUPAC name

(2E)-2-[(4-chlorophenyl)formamido]-3-(furan-2-yl)-N-(3-methoxypropyl)prop-2-enamide

SMILES

COCCCNC(/C(/NC(c(cc1)ccc1Cl)=O)=C\c1ccco1)=O

InChI

InChI=1S/C18H19ClN2O4/c1-24-10-3-9-20-18(23)16(12-15-4-2-11-25-15)21-17(22)13-5-7-14(19)8-6-13/h2,4-8,11-12H,3,9-10H2,1H3,(H,20,23)(H,21,22)

InChI Key

ZSXAYMHVBJXGMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00680814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.484

Distribution Coefficient, logD

1.427

Water Solubility, LogSw

-3.26

Polar Surface Area

62.781

Acid Dissociation Constant (pKa)

6.38

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

1309-2097 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1309-2097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1309-2097?
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What is the minimum amount of 1309-2097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1309-2097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1309-2097
  • 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 1309-2097 available by request