SD31-0028 Screening compound: 4-phenyl-N~1~-{2-[3-(1-pyrrolidinylcarbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}butanamide

SD31-0028 Screening compound: 4-phenyl-N~1~-{2-[3-(1-pyrrolidinylcarbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}butanamide
SD31-0028 Screening compound: 4-phenyl-N~1~-{2-[3-(1-pyrrolidinylcarbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD31-0028
4-phenyl-N~1~-{2-[3-(1-pyrrolidinylcarbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}butanamide

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

SD31-0028

Molecular Formula

C23H30N4O3 (C23 H30 N4 O3)

Compound Name

4-phenyl-N~1~-{2-[3-(1-pyrrolidinylcarbonyl)-6,7-dihydropyrano[4,3-c]pyrazol-1(4H)-yl]ethyl}butanamide

IUPAC name

4-phenyl-N-{2-[3-(pyrrolidine-1-carbonyl)-1H4H6H7H-pyrano[43-c]pyrazol-1-yl]ethyl}butanamide

SMILES

O=C(CCCc1ccccc1)NCCn1nc(C(N2CCCC2)=O)c2c1CCOC2

InChI

InChI=1S/C23H30N4O3/c28-21(10-6-9-18-7-2-1-3-8-18)24-12-15-27-20-11-16-30-17-19(20)22(25-27)23(29)26-13-4-5-14-26/h1-3,7-8H,4-6,9-17H2,(H,24,28)

InChI Key

WCQQITPPVAGFKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32259751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.589

Distribution Coefficient, logD

1.589

Water Solubility, LogSw

-1.79

Polar Surface Area

64.331

Acid Dissociation Constant (pKa)

13.64

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.17

SD31-0028 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with SD31-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD31-0028?
Check Price and Availability of SD31-0028, 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 SD31-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD31-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD31-0028
  • 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 SD31-0028 available by request