SB14-1162 Screening compound: N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide

SB14-1162 Screening compound: N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide
SB14-1162 Screening compound: N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB14-1162
N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide

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

SB14-1162

Molecular Formula

C20H29N3O4 (C20 H29 N3 O4)

Compound Name

N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide

IUPAC name

N-benzyl-3-[2-methoxy-N-(oxan-4-yl)acetamido]pyrrolidine-1-carboxamide

SMILES

COCC(N(C(CC1)CN1C(NCc1ccccc1)=O)C1CCOCC1)=O

InChI

InChI=1S/C20H29N3O4/c1-26-15-19(24)23(17-8-11-27-12-9-17)18-7-10-22(14-18)20(25)21-13-16-5-3-2-4-6-16/h2-6,17-18H,7-15H2,1H3,(H,21,25)/t18-/m1/s1

InChI Key

IVPKZJYFQLZHNC-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32246046

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.833

Distribution Coefficient, logD

0.833

Water Solubility, LogSw

-1.64

Polar Surface Area

57.750

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

SB14-1162 in Drug Discovery

Included in Screening Libraries

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

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB14-1162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB14-1162?
Check Price and Availability of SB14-1162, 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 SB14-1162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB14-1162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB14-1162
  • 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 SB14-1162 available by request