8017-0954 Screening compound: ethyl (Z)-3-amino-2-(4-methoxybenzoyl)-3-[(3-methoxypropyl)amino]-2-propenoate

8017-0954 Screening compound: ethyl (Z)-3-amino-2-(4-methoxybenzoyl)-3-[(3-methoxypropyl)amino]-2-propenoate
8017-0954 Screening compound: ethyl (Z)-3-amino-2-(4-methoxybenzoyl)-3-[(3-methoxypropyl)amino]-2-propenoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-0954
ethyl (Z)-3-amino-2-(4-methoxybenzoyl)-3-[(3-methoxypropyl)amino]-2-propenoate

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

8017-0954

Molecular Formula

C17H24N2O5 (C17 H24 N2 O5)

Compound Name

ethyl (Z)-3-amino-2-(4-methoxybenzoyl)-3-[(3-methoxypropyl)amino]-2-propenoate

IUPAC name

ethyl (2Z)-3-amino-2-[(Z)-4-methoxybenzoyl]-3-[(3-methoxypropyl)amino]prop-2-enoate

SMILES

CCOC(/C(/C(c(cc1)ccc1OC)=O)=C(/N)\NCCCOC)=O

InChI

InChI=1S/C17H24N2O5/c1-4-24-17(21)14(16(18)19-10-5-11-22-2)15(20)12-6-8-13(23-3)9-7-12/h6-9,19H,4-5,10-11,18H2,1-3H3

InChI Key

RCTDAADIOHENJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06014020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.778

Distribution Coefficient, logD

1.778

Water Solubility, LogSw

-2.26

Polar Surface Area

83.710

Acid Dissociation Constant (pKa)

13.40

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with 8017-0954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-0954?
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What is the minimum amount of 8017-0954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-0954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-0954
  • 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 8017-0954 available by request