Y021-3512 Screening compound: 1-(4-acetyl-5-methyl-2-phenyl-1H-pyrrol-3-yl)-4,4,6,8-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

Y021-3512 Screening compound: 1-(4-acetyl-5-methyl-2-phenyl-1H-pyrrol-3-yl)-4,4,6,8-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Y021-3512 Screening compound: 1-(4-acetyl-5-methyl-2-phenyl-1H-pyrrol-3-yl)-4,4,6,8-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-3512
1-(4-acetyl-5-methyl-2-phenyl-1H-pyrrol-3-yl)-4,4,6,8-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-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

Y021-3512

Molecular Formula

C28H28N2O2 (C28 H28 N2 O2)

Compound Name

1-(4-acetyl-5-methyl-2-phenyl-1H-pyrrol-3-yl)-4,4,6,8-tetramethyl-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one

IUPAC name

n/a

SMILES

CC1(C)N(C(C2c3c(-c4ccccc4)[nH]c(C)c3C(C)=O)=O)c3c2cc(C)cc3C(C)=C1

InChI

InChI=1S/C28H28N2O2/c1-15-12-20-16(2)14-28(5,6)30-26(20)21(13-15)23(27(30)32)24-22(18(4)31)17(3)29-25(24)19-10-8-7-9-11-19/h7-14,23,29H,1-6H3/t23-/m0/s1

InChI Key

CUDLBNWAEKYBED-QHCPKHFHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.446

Distribution Coefficient, logD

5.345

Water Solubility, LogSw

-5.57

Polar Surface Area

40.958

Acid Dissociation Constant (pKa)

7.98

Base Dissociation Constant (pKb)

-2.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with Y021-3512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-3512?
Check Price and Availability of Y021-3512, 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 Y021-3512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-3512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-3512
  • 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 Y021-3512 available by request