V011-4857 Screening compound: 2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide

V011-4857 Screening compound: 2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide
V011-4857 Screening compound: 2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-4857
2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide

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

V011-4857

Molecular Formula

C17H23N5O2S (C17 H23 N5 O2 S)

Compound Name

2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide

IUPAC name

2-[(ethylcarbamoyl)amino]-3-methyl-N-[5-(3-methylphenyl)-134-thiadiazol-2-yl]butanamide

SMILES

CCNC(NC(C(C)C)C(Nc1nnc(-c2cc(C)ccc2)s1)=O)=O

InChI

InChI=1S/C17H23N5O2S/c1-5-18-16(24)19-13(10(2)3)14(23)20-17-22-21-15(25-17)12-8-6-7-11(4)9-12/h6-10,13H,5H2,1-4H3,(H2,18,19,24)(H,20,22,23)/t13-/m0/s1

InChI Key

KSFYDEGHGUKBTB-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD20010774

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

361.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.095

Distribution Coefficient, logD

3.094

Water Solubility, LogSw

-3.26

Polar Surface Area

81.071

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

3.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

V011-4857 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V011-4857 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-4857?
Check Price and Availability of V011-4857, 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 V011-4857 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-4857
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-4857
  • 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 V011-4857 available by request