C545-0425 Screening compound: 3-butyl-1-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea

C545-0425 Screening compound: 3-butyl-1-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea
C545-0425 Screening compound: 3-butyl-1-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C545-0425
3-butyl-1-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea

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

C545-0425

Molecular Formula

C18H25N3S (C18 H25 N3 S)

Compound Name

3-butyl-1-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea

IUPAC name

3-butyl-1-[(2349-tetrahydro-1H-carbazol-6-yl)methyl]thiourea

SMILES

CCCCNC(NCc(cc1)cc2c1[nH]c1c2CCCC1)=S

InChI

InChI=1S/C18H25N3S/c1-2-3-10-19-18(22)20-12-13-8-9-17-15(11-13)14-6-4-5-7-16(14)21-17/h8-9,11,21H,2-7,10,12H2,1H3,(H2,19,20,22)

InChI Key

KPHIKRVPDWPCAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04469547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.48

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.376

Distribution Coefficient, logD

3.376

Water Solubility, LogSw

-3.57

Polar Surface Area

32.589

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

-0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with C545-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C545-0425?
Check Price and Availability of C545-0425, 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 C545-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C545-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C545-0425
  • 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 C545-0425 available by request