V019-4836 Screening compound: ethyl 6-{[4-(tert-butylcarbamoyl)-1,4-diazepan-1-yl]methyl}-4-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V019-4836 Screening compound: ethyl 6-{[4-(tert-butylcarbamoyl)-1,4-diazepan-1-yl]methyl}-4-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V019-4836 Screening compound: ethyl 6-{[4-(tert-butylcarbamoyl)-1,4-diazepan-1-yl]methyl}-4-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-4836
ethyl 6-{[4-(tert-butylcarbamoyl)-1,4-diazepan-1-yl]methyl}-4-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-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

V019-4836

Molecular Formula

C28H43N5O6 (C28 H43 N5 O6)

Compound Name

ethyl 6-{[4-(tert-butylcarbamoyl)-1,4-diazepan-1-yl]methyl}-4-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 6-{[4-(tert-butylcarbamoyl)-14-diazepan-1-yl]methyl}-4-(24-dimethoxyphenyl)-1-ethyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCN(C(CN(CCC1)CCN1C(NC(C)(C)C)=O)=C(C(c(ccc(OC)c1)c1OC)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C28H43N5O6/c1-8-33-21(18-31-13-10-14-32(16-15-31)27(36)30-28(3,4)5)23(25(34)39-9-2)24(29-26(33)35)20-12-11-19(37-6)17-22(20)38-7/h11-12,17,24H,8-10,13-16,18H2,1-7H3,(H,29,35)(H,30,36)/t24-/m1/s1

InChI Key

CJKFZSZIIROMCF-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19813367

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

545.68

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.284

Distribution Coefficient, logD

-0.426

Water Solubility, LogSw

-3.46

Polar Surface Area

93.681

Acid Dissociation Constant (pKa)

11.02

Base Dissociation Constant (pKb)

9.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.70

V019-4836 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V019-4836 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-4836?
Check Price and Availability of V019-4836, 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 V019-4836 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-4836
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-4836
  • 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 V019-4836 available by request