V029-9985 Screening compound: ethyl [(2-methoxy-5-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)carbamoyl]formate

V029-9985 Screening compound: ethyl [(2-methoxy-5-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)carbamoyl]formate
V029-9985 Screening compound: ethyl [(2-methoxy-5-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)carbamoyl]formate alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-9985
ethyl [(2-methoxy-5-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)carbamoyl]formate

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

V029-9985

Molecular Formula

C22H20N2O5 (C22 H20 N2 O5)

Compound Name

ethyl [(2-methoxy-5-{4H,5H-naphtho[1,2-c][1,2]oxazol-3-yl}phenyl)carbamoyl]formate

IUPAC name

ethyl [(2-methoxy-5-{4H5H-naphtho[12-c][12]oxazol-3-yl}phenyl)carbamoyl]formate

SMILES

CCOC(C(Nc(cc(cc1)-c2c(CCc3c-4cccc3)c4no2)c1OC)=O)=O

InChI

InChI=1S/C22H20N2O5/c1-3-28-22(26)21(25)23-17-12-14(9-11-18(17)27-2)20-16-10-8-13-6-4-5-7-15(13)19(16)24-29-20/h4-7,9,11-12H,3,8,10H2,1-2H3,(H,23,25)

InChI Key

BMINJUAEVZUOTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19963697

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.293

Distribution Coefficient, logD

4.286

Water Solubility, LogSw

-4.27

Polar Surface Area

73.566

Acid Dissociation Constant (pKa)

9.19

Base Dissociation Constant (pKb)

3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

V029-9985 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V029-9985 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-9985?
Check Price and Availability of V029-9985, 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 V029-9985 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-9985
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-9985
  • 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 V029-9985 available by request