S836-4736 Screening compound: 4-(HYDROXYMETHYL)-N~3~,N~3~-DIMETHYL-1-(3-PHENYLPROPYL)-3-PYRROLIDINECARBOXAMIDE

S836-4736 Screening compound: 4-(HYDROXYMETHYL)-N~3~,N~3~-DIMETHYL-1-(3-PHENYLPROPYL)-3-PYRROLIDINECARBOXAMIDE
S836-4736 Screening compound: 4-(HYDROXYMETHYL)-N~3~,N~3~-DIMETHYL-1-(3-PHENYLPROPYL)-3-PYRROLIDINECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S836-4736
4-(HYDROXYMETHYL)-N~3~,N~3~-DIMETHYL-1-(3-PHENYLPROPYL)-3-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

S836-4736

Molecular Formula

C17H26N2O2 (C17 H26 N2 O2)

Compound Name

4-(HYDROXYMETHYL)-N~3~,N~3~-DIMETHYL-1-(3-PHENYLPROPYL)-3-PYRROLIDINECARBOXAMIDE

IUPAC name

n/a

SMILES

CN(C)C([C@@H]1[C@@H](CO)CN(CCCc2ccccc2)C1)=O

InChI

InChI=1S/C17H26N2O2/c1-18(2)17(21)16-12-19(11-15(16)13-20)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,15-16,20H,6,9-13H2,1-2H3/t15-,16+/m1/s1

InChI Key

CELDKDDLHYKJNE-CVEARBPZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.084

Distribution Coefficient, logD

-2.233

Water Solubility, LogSw

-1.90

Polar Surface Area

37.298

Acid Dissociation Constant (pKa)

16.13

Base Dissociation Constant (pKb)

10.72

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

58.80

References: we are preparing a list of scientific research reports with S836-4736 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S836-4736?
Check Price and Availability of S836-4736, 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 S836-4736 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S836-4736
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S836-4736
  • 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 S836-4736 available by request