M050-0713 Screening compound: ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-1,2-thiazole-5-carbonyl)piperazine-1-carboxylate

M050-0713 Screening compound: ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-1,2-thiazole-5-carbonyl)piperazine-1-carboxylate
M050-0713 Screening compound: ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-1,2-thiazole-5-carbonyl)piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound M050-0713
ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-1,2-thiazole-5-carbonyl)piperazine-1-carboxylate

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

M050-0713

Molecular Formula

C20H25N5O5S (C20 H25 N5 O5 S)

Compound Name

ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-1,2-thiazole-5-carbonyl)piperazine-1-carboxylate

IUPAC name

ethyl 4-(4-amino-3-{[(4-methoxyphenyl)methyl]carbamoyl}-12-thiazole-5-carbonyl)piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c(snc1C(NCc(cc2)ccc2OC)=O)c1N)=O)=O

InChI

InChI=1S/C20H25N5O5S/c1-3-30-20(28)25-10-8-24(9-11-25)19(27)17-15(21)16(23-31-17)18(26)22-12-13-4-6-14(29-2)7-5-13/h4-7H,3,8-12,21H2,1-2H3,(H,22,26)

InChI Key

QXSBKVKPTUOGMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15139745

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.554

Distribution Coefficient, logD

1.554

Water Solubility, LogSw

-2.37

Polar Surface Area

102.272

Acid Dissociation Constant (pKa)

13.20

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

M050-0713 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 M050-0713 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M050-0713?
Check Price and Availability of M050-0713, 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 M050-0713 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M050-0713
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M050-0713
  • 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 M050-0713 available by request