4879-0627 Screening compound: 1,6-dimethyl-3H,7H,8H,9H,10H,11H-pyrano[2,3-c]carbazol-3-one

4879-0627 Screening compound: 1,6-dimethyl-3H,7H,8H,9H,10H,11H-pyrano[2,3-c]carbazol-3-one
4879-0627 Screening compound: 1,6-dimethyl-3H,7H,8H,9H,10H,11H-pyrano[2,3-c]carbazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4879-0627
1,6-dimethyl-3H,7H,8H,9H,10H,11H-pyrano[2,3-c]carbazol-3-one

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

4879-0627

Molecular Formula

C17H17NO2 (C17 H17 NO2)

Compound Name

1,6-dimethyl-3H,7H,8H,9H,10H,11H-pyrano[2,3-c]carbazol-3-one

IUPAC name

16-dimethyl-3H7H8H9H10H11H-pyrano[23-c]carbazol-3-one

SMILES

Cc(c1c2c(CCCC3)c3[nH]1)cc(O1)c2C(C)=CC1=O

InChI

InChI=1S/C17H17NO2/c1-9-8-14(19)20-13-7-10(2)17-16(15(9)13)11-5-3-4-6-12(11)18-17/h7-8,18H,3-6H2,1-2H3

InChI Key

NGEWVIJBCBCZSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02321378

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.517

Distribution Coefficient, logD

3.517

Water Solubility, LogSw

-4.20

Polar Surface Area

32.187

Acid Dissociation Constant (pKa)

19.45

Base Dissociation Constant (pKb)

-3.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

4879-0627 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 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 4879-0627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4879-0627?
Check Price and Availability of 4879-0627, 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 4879-0627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4879-0627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4879-0627
  • 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 4879-0627 available by request