8018-7940 Screening compound: 2,3-dihydro-1H-pyrido[3,2,1-kl]phenoxazine-9-carboxylic acid

8018-7940 Screening compound: 2,3-dihydro-1H-pyrido[3,2,1-kl]phenoxazine-9-carboxylic acid
8018-7940 Screening compound: 2,3-dihydro-1H-pyrido[3,2,1-kl]phenoxazine-9-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7940
2,3-dihydro-1H-pyrido[3,2,1-kl]phenoxazine-9-carboxylic 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

8018-7940

Molecular Formula

C16H13NO3 (C16 H13 NO3)

Compound Name

2,3-dihydro-1H-pyrido[3,2,1-kl]phenoxazine-9-carboxylic acid

IUPAC name

8-oxa-1-azatetracyclo[7.7.1.0^{27}.0^{1317}]heptadeca-2(7)3591113(17)-hexaene-5-carboxylic acid

SMILES

OC(c(cc1)cc2c1N(CCCc1ccc3)c1c3O2)=O

InChI

InChI=1S/C16H13NO3/c18-16(19)11-6-7-12-14(9-11)20-13-5-1-3-10-4-2-8-17(12)15(10)13/h1,3,5-7,9H,2,4,8H2,(H,18,19)

InChI Key

XYWYPKVJMDNAKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08532342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.516

Distribution Coefficient, logD

1.180

Water Solubility, LogSw

-3.72

Polar Surface Area

38.715

Acid Dissociation Constant (pKa)

5.07

Base Dissociation Constant (pKb)

-0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8018-7940 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8018-7940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7940?
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What is the minimum amount of 8018-7940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7940
  • 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 8018-7940 available by request