Y041-1497 Screening compound: 6-methyl-4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate

Y041-1497 Screening compound: 6-methyl-4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate
Y041-1497 Screening compound: 6-methyl-4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1497
6-methyl-4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate

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

Y041-1497

Molecular Formula

C23H23NO6S (C23 H23 NO6 S)

Compound Name

6-methyl-4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate

IUPAC name

6-methyl-4-oxo-1H2H3H4H-cyclopenta[c]chromen-7-yl 3-(4-methylbenzenesulfonamido)propanoate

SMILES

Cc(cc1)ccc1S(NCCC(Oc(cc1)c(C)c(O2)c1C(CCC1)=C1C2=O)=O)(=O)=O

InChI

InChI=1S/C23H23NO6S/c1-14-6-8-16(9-7-14)31(27,28)24-13-12-21(25)29-20-11-10-18-17-4-3-5-19(17)23(26)30-22(18)15(20)2/h6-11,24H,3-5,12-13H2,1-2H3

InChI Key

JZYGFSPBFZCWPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04016536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.850

Distribution Coefficient, logD

3.850

Water Solubility, LogSw

-4.03

Polar Surface Area

82.872

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-6.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with Y041-1497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1497?
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What is the minimum amount of Y041-1497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1497
  • 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 Y041-1497 available by request