0095-0147 Screening compound: propan-2-yl N-(3-chlorophenyl)carbamate

0095-0147 Screening compound: propan-2-yl N-(3-chlorophenyl)carbamate
0095-0147 Screening compound: propan-2-yl N-(3-chlorophenyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0095-0147
propan-2-yl N-(3-chlorophenyl)carbamate

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

0095-0147

Molecular Formula

C10H12ClNO2 (C10 H12 ClNO2)

Compound Name

propan-2-yl N-(3-chlorophenyl)carbamate

IUPAC name

propan-2-yl N-(3-chlorophenyl)carbamate

SMILES

CC(C)OC(Nc1cccc(Cl)c1)=O

InChI

InChI=1S/C10H12ClNO2/c1-7(2)14-10(13)12-9-5-3-4-8(11)6-9/h3-7H,1-2H3,(H,12,13)

InChI Key

CWJSHJJYOPWUGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00037108

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

213.66

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.632

Distribution Coefficient, logD

3.631

Water Solubility, LogSw

-3.53

Polar Surface Area

31.361

Acid Dissociation Constant (pKa)

10.46

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

0095-0147 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0095-0147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0095-0147?
Check Price and Availability of 0095-0147, 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 0095-0147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0095-0147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0095-0147
  • 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 0095-0147 available by request