V015-1038 Screening compound: ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V015-1038 Screening compound: ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V015-1038 Screening compound: ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-1038
ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-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

V015-1038

Molecular Formula

C30H31BrN4O4 (C30 H31 BrN4 O4)

Compound Name

ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 4-(3-{[(3-bromophenyl)carbamoyl]amino}phenyl)-1-butyl-2-oxo-6-phenyl-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCCN(C(c1ccccc1)=C(C(c1cccc(NC(Nc2cccc(Br)c2)=O)c1)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C30H31BrN4O4/c1-3-5-17-35-27(20-11-7-6-8-12-20)25(28(36)39-4-2)26(34-30(35)38)21-13-9-15-23(18-21)32-29(37)33-24-16-10-14-22(31)19-24/h6-16,18-19,26H,3-5,17H2,1-2H3,(H,34,38)(H2,32,33,37)/t26-/m0/s1

InChI Key

ZBZBPDJMMGXQEU-SANMLTNESA-N

MDL Number (MFCD)

MFCD13267998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

591.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.700

Distribution Coefficient, logD

7.700

Water Solubility, LogSw

-5.59

Polar Surface Area

81.082

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

V015-1038 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V015-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-1038?
Check Price and Availability of V015-1038, 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 V015-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-1038
  • 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 V015-1038 available by request