Y043-2691 Screening compound: 6,7-dimethoxy-2-[4-(1H-1,2,3,4-tetrazol-1-yl)benzoyl]-1,2,3,4-tetrahydroisoquinoline

Y043-2691 Screening compound: 6,7-dimethoxy-2-[4-(1H-1,2,3,4-tetrazol-1-yl)benzoyl]-1,2,3,4-tetrahydroisoquinoline
Y043-2691 Screening compound: 6,7-dimethoxy-2-[4-(1H-1,2,3,4-tetrazol-1-yl)benzoyl]-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-2691
6,7-dimethoxy-2-[4-(1H-1,2,3,4-tetrazol-1-yl)benzoyl]-1,2,3,4-tetrahydroisoquinoline

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

Y043-2691

Molecular Formula

C19H19N5O3 (C19 H19 N5 O3)

Compound Name

6,7-dimethoxy-2-[4-(1H-1,2,3,4-tetrazol-1-yl)benzoyl]-1,2,3,4-tetrahydroisoquinoline

IUPAC name

67-dimethoxy-2-[4-(1H-1234-tetrazol-1-yl)benzoyl]-1234-tetrahydroisoquinoline

SMILES

COc1cc(CCN(C2)C(c(cc3)ccc3-n3nnnc3)=O)c2cc1OC

InChI

InChI=1S/C19H19N5O3/c1-26-17-9-14-7-8-23(11-15(14)10-18(17)27-2)19(25)13-3-5-16(6-4-13)24-12-20-21-22-24/h3-6,9-10,12H,7-8,11H2,1-2H3

InChI Key

WBQLCJJWOPLTGJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.813

Distribution Coefficient, logD

1.813

Water Solubility, LogSw

-2.39

Polar Surface Area

71.575

Acid Dissociation Constant (pKa)

25.26

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with Y043-2691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-2691?
Check Price and Availability of Y043-2691, 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 Y043-2691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-2691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-2691
  • 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 Y043-2691 available by request