Y202-9907 Screening compound: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate

Y202-9907 Screening compound: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate
Y202-9907 Screening compound: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y202-9907
2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate

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

Y202-9907

Molecular Formula

C18H18N4O6 (C18 H18 N4 O6)

Compound Name

2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate

IUPAC name

2-[(4-nitro-213-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate

SMILES

CCCOc(cc1)ccc1C(OCCNc(ccc1nonc11)c1[N+]([O-])=O)=O

InChI

InChI=1S/C18H18N4O6/c1-2-10-26-13-5-3-12(4-6-13)18(23)27-11-9-19-15-8-7-14-16(21-28-20-14)17(15)22(24)25/h3-8,19H,2,9-11H2,1H3

InChI Key

AXSGPAOYKYYARO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.36

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.198

Distribution Coefficient, logD

5.198

Water Solubility, LogSw

-5.12

Polar Surface Area

106.952

Acid Dissociation Constant (pKa)

15.62

Base Dissociation Constant (pKb)

-4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.78

References: we are preparing a list of scientific research reports with Y202-9907 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y202-9907?
Check Price and Availability of Y202-9907, 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 Y202-9907 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y202-9907
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y202-9907
  • 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 Y202-9907 available by request