D620-0770 Screening compound: 1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-1,3-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-one

D620-0770 Screening compound: 1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-1,3-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-one
D620-0770 Screening compound: 1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-1,3-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D620-0770
1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-1,3-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-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

D620-0770

Molecular Formula

C23H25N3O6S (C23 H25 N3 O6 S)

Compound Name

1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-1,3-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-one

IUPAC name

1-{4-[4-(benzenesulfonyl)-2-(3-methoxyphenyl)-13-oxazol-5-yl]piperazin-1-yl}-2-methoxyethan-1-one

SMILES

COCC(N(CC1)CCN1c(oc(-c1cc(OC)ccc1)n1)c1S(c1ccccc1)(=O)=O)=O

InChI

InChI=1S/C23H25N3O6S/c1-30-16-20(27)25-11-13-26(14-12-25)23-22(33(28,29)19-9-4-3-5-10-19)24-21(32-23)17-7-6-8-18(15-17)31-2/h3-10,15H,11-14,16H2,1-2H3

InChI Key

YOYUMDPXLNTVOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18172706

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.384

Distribution Coefficient, logD

2.384

Water Solubility, LogSw

-2.79

Polar Surface Area

83.647

Acid Dissociation Constant (pKa)

22.40

Base Dissociation Constant (pKb)

-1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

D620-0770 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D620-0770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D620-0770?
Check Price and Availability of D620-0770, 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 D620-0770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D620-0770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D620-0770
  • 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 D620-0770 available by request