1630-0684 Screening compound: 2-phenylethyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

1630-0684 Screening compound: 2-phenylethyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
1630-0684 Screening compound: 2-phenylethyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1630-0684
2-phenylethyl 4-(3,4-dichlorophenyl)-6-methyl-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

1630-0684

Molecular Formula

C20H18Cl2N2O3 (C20 H18 Cl2 N2 O3)

Compound Name

2-phenylethyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

2-phenylethyl 4-(34-dichlorophenyl)-6-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CC(NC(NC1c(cc2)cc(Cl)c2Cl)=O)=C1C(OCCc1ccccc1)=O

InChI

InChI=1S/C20H18Cl2N2O3/c1-12-17(19(25)27-10-9-13-5-3-2-4-6-13)18(24-20(26)23-12)14-7-8-15(21)16(22)11-14/h2-8,11,18H,9-10H2,1H3,(H2,23,24,26)/t18-/m0/s1

InChI Key

CATCPDGCRILVHZ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD00355907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.619

Distribution Coefficient, logD

4.468

Water Solubility, LogSw

-4.84

Polar Surface Area

56.468

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

-4.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 1630-0684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1630-0684?
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What is the minimum amount of 1630-0684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1630-0684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1630-0684
  • 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 1630-0684 available by request