SC19-0779 Screening compound: N-({1-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-4-piperidyl}methyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

SC19-0779 Screening compound: N-({1-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-4-piperidyl}methyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
SC19-0779 Screening compound: N-({1-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-4-piperidyl}methyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC19-0779
N-({1-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-4-piperidyl}methyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

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

SC19-0779

Molecular Formula

C21H31N5O2S (C21 H31 N5 O2 S)

Compound Name

N-({1-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]-4-piperidyl}methyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

IUPAC name

N-{[1-({1-ethyl-1H4H6H7H-pyrano[43-c]pyrazol-3-yl}methyl)piperidin-4-yl]methyl}-24-dimethyl-13-thiazole-5-carboxamide

SMILES

CCn1nc(CN2CCC(CNC(c3c(C)nc(C)s3)=O)CC2)c2c1CCOC2

InChI

InChI=1S/C21H31N5O2S/c1-4-26-19-7-10-28-13-17(19)18(24-26)12-25-8-5-16(6-9-25)11-22-21(27)20-14(2)23-15(3)29-20/h16H,4-13H2,1-3H3,(H,22,27)

InChI Key

CAMHWJKIBKRMAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32256772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.579

Distribution Coefficient, logD

-4.662

Water Solubility, LogSw

-1.95

Polar Surface Area

62.052

Acid Dissociation Constant (pKa)

13.16

Base Dissociation Constant (pKb)

13.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

SC19-0779 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SC19-0779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC19-0779?
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What is the minimum amount of SC19-0779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC19-0779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC19-0779
  • 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 SC19-0779 available by request