4464-1019 Screening compound: methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate

4464-1019 Screening compound: methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate
4464-1019 Screening compound: methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4464-1019
methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate

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

4464-1019

Molecular Formula

C14H25N3O7 (C14 H25 N3 O7)

Compound Name

methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate

IUPAC name

methyl 2-[2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)propanamido]-3-hydroxypropanoate

SMILES

CC(C(NC(CO)C(OC)=O)=O)NC(CNC(OC(C)(C)C)=O)=O

InChI

InChI=1S/C14H25N3O7/c1-8(11(20)17-9(7-18)12(21)23-5)16-10(19)6-15-13(22)24-14(2,3)4/h8-9,18H,6-7H2,1-5H3,(H,15,22)(H,16,19)(H,17,20)

InChI Key

RYRSUXJUCJQSDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02734106

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.37

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.042

Distribution Coefficient, logD

-0.042

Water Solubility, LogSw

-0.82

Polar Surface Area

118.624

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

71.40

4464-1019 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4464-1019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4464-1019?
Check Price and Availability of 4464-1019, 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 4464-1019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4464-1019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4464-1019
  • 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 4464-1019 available by request