C795-0379 Screening compound: 1-(2,5-dimethylphenyl)-3-(thiophen-2-yl)urea

C795-0379 Screening compound: 1-(2,5-dimethylphenyl)-3-(thiophen-2-yl)urea
C795-0379 Screening compound: 1-(2,5-dimethylphenyl)-3-(thiophen-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0379
1-(2,5-dimethylphenyl)-3-(thiophen-2-yl)urea

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

C795-0379

Molecular Formula

C13H14N2OS (C13 H14 N2 OS)

Compound Name

1-(2,5-dimethylphenyl)-3-(thiophen-2-yl)urea

IUPAC name

1-(25-dimethylphenyl)-3-(thiophen-2-yl)urea

SMILES

Cc1cc(NC(Nc2cccs2)=O)c(C)cc1

InChI

InChI=1S/C13H14N2OS/c1-9-5-6-10(2)11(8-9)14-13(16)15-12-4-3-7-17-12/h3-8H,1-2H3,(H2,14,15,16)

InChI Key

WAEPUGFHICWAPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14796869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.33

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.183

Distribution Coefficient, logD

3.183

Water Solubility, LogSw

-3.11

Polar Surface Area

32.336

Acid Dissociation Constant (pKa)

12.24

Base Dissociation Constant (pKb)

-1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C795-0379 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C795-0379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0379?
Check Price and Availability of C795-0379, 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 C795-0379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0379
  • 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 C795-0379 available by request