SB95-1172 Screening compound: N-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

SB95-1172 Screening compound: N-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide
SB95-1172 Screening compound: N-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB95-1172
N-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

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

SB95-1172

Molecular Formula

C21H32N4O3S (C21 H32 N4 O3 S)

Compound Name

N-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]-3-piperidyl}-N-(2-morpholinoethyl)-1-cyclopropanecarboxamide

IUPAC name

N-[1-(24-dimethyl-13-thiazole-5-carbonyl)piperidin-3-yl]-N-[2-(morpholin-4-yl)ethyl]cyclopropanecarboxamide

SMILES

Cc1c(C(N(CCC2)CC2N(CCN2CCOCC2)C(C2CC2)=O)=O)sc(C)n1

InChI

InChI=1S/C21H32N4O3S/c1-15-19(29-16(2)22-15)21(27)24-7-3-4-18(14-24)25(20(26)17-5-6-17)9-8-23-10-12-28-13-11-23/h17-18H,3-14H2,1-2H3/t18-/m0/s1

InChI Key

GXBVBUQDHJTIHO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32252600

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.472

Distribution Coefficient, logD

1.423

Water Solubility, LogSw

-1.77

Polar Surface Area

54.594

Acid Dissociation Constant (pKa)

23.49

Base Dissociation Constant (pKb)

6.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.19

SB95-1172 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB95-1172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB95-1172?
Check Price and Availability of SB95-1172, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of SB95-1172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB95-1172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB95-1172
  • 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 SB95-1172 available by request