V020-3339 Screening compound: 1-{6-butyl-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-1,4-diazepane

V020-3339 Screening compound: 1-{6-butyl-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-1,4-diazepane
V020-3339 Screening compound: 1-{6-butyl-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-3339
1-{6-butyl-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-1,4-diazepane

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

V020-3339

Molecular Formula

C28H31N5O2 (C28 H31 N5 O2)

Compound Name

1-{6-butyl-3-phenyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-1,4-diazepane

IUPAC name

1-{6-butyl-3-phenyl-[12]oxazolo[54-d]pyrimidin-4-yl}-4-(2-methylbenzoyl)-14-diazepane

SMILES

CCCCc1nc(onc2-c3ccccc3)c2c(N(CCC2)CCN2C(c2c(C)cccc2)=O)n1

InChI

InChI=1S/C28H31N5O2/c1-3-4-15-23-29-26(24-25(31-35-27(24)30-23)21-12-6-5-7-13-21)32-16-10-17-33(19-18-32)28(34)22-14-9-8-11-20(22)2/h5-9,11-14H,3-4,10,15-19H2,1-2H3

InChI Key

VCXHBDWEFKZVKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19937703

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

469.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.720

Distribution Coefficient, logD

5.720

Water Solubility, LogSw

-5.77

Polar Surface Area

62.074

Acid Dissociation Constant (pKa)

21.58

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V020-3339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-3339?
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What is the minimum amount of V020-3339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-3339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-3339
  • 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 V020-3339 available by request