3132-0181 Screening compound: 6-amino-4-(3,4-dimethoxyphenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

3132-0181 Screening compound: 6-amino-4-(3,4-dimethoxyphenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile
3132-0181 Screening compound: 6-amino-4-(3,4-dimethoxyphenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 3132-0181
6-amino-4-(3,4-dimethoxyphenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

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

3132-0181

Molecular Formula

C18H20N4O3 (C18 H20 N4 O3)

Compound Name

6-amino-4-(3,4-dimethoxyphenyl)-3-propyl-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

IUPAC name

6-amino-4-(34-dimethoxyphenyl)-3-propyl-2H4H-pyrano[23-c]pyrazole-5-carbonitrile

SMILES

CCCc1c(C(c(cc2)cc(OC)c2OC)C(C#N)=C(N)O2)c2n[nH]1

InChI

InChI=1S/C18H20N4O3/c1-4-5-12-16-15(10-6-7-13(23-2)14(8-10)24-3)11(9-19)17(20)25-18(16)22-21-12/h6-8,15H,4-5,20H2,1-3H3,(H,21,22)/t15-/m1/s1

InChI Key

DCTUHPSFRIADES-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD01605282

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.376

Distribution Coefficient, logD

2.376

Water Solubility, LogSw

-2.80

Polar Surface Area

86.501

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 3132-0181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3132-0181?
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What is the minimum amount of 3132-0181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3132-0181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3132-0181
  • 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 3132-0181 available by request