1361-0037 Screening compound: (butoxycarbonyl)(propyl)amino N-phenylcarbamate

1361-0037 Screening compound: (butoxycarbonyl)(propyl)amino N-phenylcarbamate
1361-0037 Screening compound: (butoxycarbonyl)(propyl)amino N-phenylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1361-0037
(butoxycarbonyl)(propyl)amino N-phenylcarbamate

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

1361-0037

Molecular Formula

C15H22N2O4 (C15 H22 N2 O4)

Compound Name

(butoxycarbonyl)(propyl)amino N-phenylcarbamate

IUPAC name

butyl N-[(phenylcarbamoyl)oxy]-N-propylcarbamate

SMILES

CCCCOC(N(CCC)OC(Nc1ccccc1)=O)=O

InChI

InChI=1S/C15H22N2O4/c1-3-5-12-20-15(19)17(11-4-2)21-14(18)16-13-9-7-6-8-10-13/h6-10H,3-5,11-12H2,1-2H3,(H,16,18)

InChI Key

OKHKHDXVIZSCBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00419769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.495

Distribution Coefficient, logD

3.480

Water Solubility, LogSw

-3.52

Polar Surface Area

57.780

Acid Dissociation Constant (pKa)

8.91

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

1361-0037 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1361-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1361-0037?
Check Price and Availability of 1361-0037, 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 1361-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1361-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1361-0037
  • 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 1361-0037 available by request