C909-0210 Screening compound: methyl 3-[({12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate

C909-0210 Screening compound: methyl 3-[({12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate
C909-0210 Screening compound: methyl 3-[({12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0210
methyl 3-[({12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate

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

C909-0210

Molecular Formula

C21H20N4O5S (C21 H20 N4 O5 S)

Compound Name

methyl 3-[({12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate

IUPAC name

methyl 3-[({12-oxo-6H7H8H9H10H12H-azepino[21-b]quinazolin-2-yl}carbamoyl)formamido]thiophene-2-carboxylate

SMILES

COC(c(scc1)c1NC(C(Nc(cc1)cc2c1N=C(CCCCC1)N1C2=O)=O)=O)=O

InChI

InChI=1S/C21H20N4O5S/c1-30-21(29)17-15(8-10-31-17)24-19(27)18(26)22-12-6-7-14-13(11-12)20(28)25-9-4-2-3-5-16(25)23-14/h6-8,10-11H,2-5,9H2,1H3,(H,22,26)(H,24,27)

InChI Key

VUJXWRJWEPNOTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14808012

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.971

Distribution Coefficient, logD

-0.120

Water Solubility, LogSw

-2.97

Polar Surface Area

94.668

Acid Dissociation Constant (pKa)

5.31

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

C909-0210 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C909-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0210?
Check Price and Availability of C909-0210, 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 C909-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0210
  • 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 C909-0210 available by request