C200-9014 Screening compound: 1-[1]benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid

C200-9014 Screening compound: 1-[1]benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid
C200-9014 Screening compound: 1-[1]benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9014
1-[1]benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic 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

C200-9014

Molecular Formula

C16H15N3O3 (C16 H15 N3 O3)

Compound Name

1-[1]benzofuro[3,2-d]pyrimidin-4-yl-4-piperidinecarboxylic acid

IUPAC name

1-{8-oxa-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}piperidine-4-carboxylic acid

SMILES

OC(C(CC1)CCN1c1ncnc2c1oc1c2cccc1)=O

InChI

InChI=1S/C16H15N3O3/c20-16(21)10-5-7-19(8-6-10)15-14-13(17-9-18-15)11-3-1-2-4-12(11)22-14/h1-4,9-10H,5-8H2,(H,20,21)

InChI Key

DZILGYLWRFMPOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04185539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.320

Distribution Coefficient, logD

-0.233

Water Solubility, LogSw

-2.31

Polar Surface Area

60.747

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

C200-9014 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with C200-9014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9014?
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What is the minimum amount of C200-9014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9014
  • 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 C200-9014 available by request