V024-6512 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine

V024-6512 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine
V024-6512 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6512
N-[2-(3,4-dimethoxyphenyl)ethyl]-N,6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine

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

V024-6512

Molecular Formula

C28H34N4O3S (C28 H34 N4 O3 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-N,6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-N6-dimethyl-2-({[4-(pyrrolidine-1-carbonyl)phenyl]methyl}sulfanyl)pyrimidin-4-amine

SMILES

Cc1nc(SCc(cc2)ccc2C(N2CCCC2)=O)nc(N(C)CCc(cc2)cc(OC)c2OC)c1

InChI

InChI=1S/C28H34N4O3S/c1-20-17-26(31(2)16-13-21-9-12-24(34-3)25(18-21)35-4)30-28(29-20)36-19-22-7-10-23(11-8-22)27(33)32-14-5-6-15-32/h7-12,17-18H,5-6,13-16,19H2,1-4H3

InChI Key

XCSDMMLPBYXLKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19822166

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

506.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.199

Distribution Coefficient, logD

4.196

Water Solubility, LogSw

-4.25

Polar Surface Area

51.738

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

5.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with V024-6512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6512?
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What is the minimum amount of V024-6512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6512
  • 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 V024-6512 available by request