F874-0759 Screening compound: ethyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate

F874-0759 Screening compound: ethyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate
F874-0759 Screening compound: ethyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F874-0759
ethyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate

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

F874-0759

Molecular Formula

C17H21ClN4O4 (C17 H21 ClN4 O4)

Compound Name

ethyl 2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate

IUPAC name

ethyl 2-({4-[(5-chloro-13-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)acetate

SMILES

CCOC(CNC(N1CCN(Cc2nc(cc(cc3)Cl)c3o2)CC1)=O)=O

InChI

InChI=1S/C17H21ClN4O4/c1-2-25-16(23)10-19-17(24)22-7-5-21(6-8-22)11-15-20-13-9-12(18)3-4-14(13)26-15/h3-4,9H,2,5-8,10-11H2,1H3,(H,19,24)

InChI Key

RKITWVRMXYBGRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27201585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

1.832

Water Solubility, LogSw

-2.85

Polar Surface Area

67.748

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

F874-0759 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F874-0759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F874-0759?
Check Price and Availability of F874-0759, 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 F874-0759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F874-0759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F874-0759
  • 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 F874-0759 available by request