D383-0121 Screening compound: 5-(2-bromophenyl)-1,3-dimethyl-10-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione

D383-0121 Screening compound: 5-(2-bromophenyl)-1,3-dimethyl-10-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
D383-0121 Screening compound: 5-(2-bromophenyl)-1,3-dimethyl-10-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D383-0121
5-(2-bromophenyl)-1,3-dimethyl-10-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione

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

D383-0121

Molecular Formula

C24H22BrN3O3 (C24 H22 BrN3 O3)

Compound Name

5-(2-bromophenyl)-1,3-dimethyl-10-(4-methylphenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione

IUPAC name

8-(2-bromophenyl)-35-dimethyl-13-(4-methylphenyl)-12-oxa-359-triazatricyclo[7.4.0.0^{27}]trideca-17-diene-46-dione

SMILES

Cc1ccc(C(c2c3N(C)C(N4C)=O)OCCn2c(-c(cccc2)c2Br)c3C4=O)cc1

InChI

InChI=1S/C24H22BrN3O3/c1-14-8-10-15(11-9-14)22-21-20-18(23(29)27(3)24(30)26(20)2)19(28(21)12-13-31-22)16-6-4-5-7-17(16)25/h4-11,22H,12-13H2,1-3H3/t22-/m1/s1

InChI Key

TZJQWGHNADUJIY-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD09662090

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.877

Distribution Coefficient, logD

4.877

Water Solubility, LogSw

-4.72

Polar Surface Area

40.380

Acid Dissociation Constant (pKa)

24.88

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D383-0121 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D383-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D383-0121?
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What is the minimum amount of D383-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D383-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D383-0121
  • 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 D383-0121 available by request