SB04-0361 Screening compound: 1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine

SB04-0361 Screening compound: 1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine
SB04-0361 Screening compound: 1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound SB04-0361
1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine

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

SB04-0361

Molecular Formula

C18H34N4O4S (C18 H34 N4 O4 S)

Compound Name

1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine

IUPAC name

1-cyclopropanecarbonyl-N-{2-[(dimethylsulfamoyl)(methyl)amino]ethyl}-N-(oxan-4-yl)pyrrolidin-3-amine

SMILES

CN(C)S(N(C)CCN(C(CC1)CN1C(C1CC1)=O)C1CCOCC1)(=O)=O

InChI

InChI=1S/C18H34N4O4S/c1-19(2)27(24,25)20(3)10-11-22(16-7-12-26-13-8-16)17-6-9-21(14-17)18(23)15-4-5-15/h15-17H,4-14H2,1-3H3/t17-/m0/s1

InChI Key

MCBYQLLJAPNVAT-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32246605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.446

Distribution Coefficient, logD

-0.206

Water Solubility, LogSw

-1.16

Polar Surface Area

64.398

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

7.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

94.44

SB04-0361 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SB04-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB04-0361?
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What is the minimum amount of SB04-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB04-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB04-0361
  • 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 SB04-0361 available by request