SB91-1533 Screening compound: 3-[acetyl(2-morpholinoethyl)amino]-N-(3,4-dimethoxyphenyl)-1-pyrrolidinecarboxamide

SB91-1533 Screening compound: 3-[acetyl(2-morpholinoethyl)amino]-N-(3,4-dimethoxyphenyl)-1-pyrrolidinecarboxamide
SB91-1533 Screening compound: 3-[acetyl(2-morpholinoethyl)amino]-N-(3,4-dimethoxyphenyl)-1-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB91-1533
3-[acetyl(2-morpholinoethyl)amino]-N-(3,4-dimethoxyphenyl)-1-pyrrolidinecarboxamide

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

SB91-1533

Molecular Formula

C21H32N4O5 (C21 H32 N4 O5)

Compound Name

3-[acetyl(2-morpholinoethyl)amino]-N-(3,4-dimethoxyphenyl)-1-pyrrolidinecarboxamide

IUPAC name

N-(34-dimethoxyphenyl)-3-{N-[2-(morpholin-4-yl)ethyl]acetamido}pyrrolidine-1-carboxamide

SMILES

CC(N(CCN1CCOCC1)C(CC1)CN1C(Nc(cc1)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C21H32N4O5/c1-16(26)25(9-8-23-10-12-30-13-11-23)18-6-7-24(15-18)21(27)22-17-4-5-19(28-2)20(14-17)29-3/h4-5,14,18H,6-13,15H2,1-3H3,(H,22,27)/t18-/m1/s1

InChI Key

FPQWKTPOKCCKJJ-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32250395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.351

Distribution Coefficient, logD

0.318

Water Solubility, LogSw

-1.87

Polar Surface Area

68.869

Acid Dissociation Constant (pKa)

12.72

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

References: we are preparing a list of scientific research reports with SB91-1533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB91-1533?
Check Price and Availability of SB91-1533, 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 SB91-1533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB91-1533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB91-1533
  • 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 SB91-1533 available by request