V014-3518 Screening compound: 2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V014-3518 Screening compound: 2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V014-3518 Screening compound: 2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-3518
2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-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

V014-3518

Molecular Formula

C26H31N5O6 (C26 H31 N5 O6)

Compound Name

2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

2-methylpropyl 6-methyl-4-(3-{[(4-nitrophenyl)carbamoyl]amino}phenyl)-2-oxo-1-propyl-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCN(C(C)=C(C(c1cccc(NC(Nc(cc2)ccc2[N+]([O-])=O)=O)c1)N1)C(OCC(C)C)=O)C1=O

InChI

InChI=1S/C26H31N5O6/c1-5-13-30-17(4)22(24(32)37-15-16(2)3)23(29-26(30)34)18-7-6-8-20(14-18)28-25(33)27-19-9-11-21(12-10-19)31(35)36/h6-12,14,16,23H,5,13,15H2,1-4H3,(H,29,34)(H2,27,28,33)/t23-/m0/s1

InChI Key

HYHFKMFCPPQSKA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14241417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.442

Distribution Coefficient, logD

5.441

Water Solubility, LogSw

-5.42

Polar Surface Area

114.701

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

V014-3518 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V014-3518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-3518?
Check Price and Availability of V014-3518, 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 V014-3518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-3518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-3518
  • 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 V014-3518 available by request