8012-2262 Screening compound: 3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea

8012-2262 Screening compound: 3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea
8012-2262 Screening compound: 3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-2262
3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea

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

8012-2262

Molecular Formula

C18H15Cl2F2N3O2S (C18 H15 Cl2 F2 N3 O2 S)

Compound Name

3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea

IUPAC name

3-[4-(chlorodifluoromethoxy)phenyl]-1-(3-chlorophenyl)-3-(5-methyl-45-dihydro-13-thiazol-2-yl)urea

SMILES

CC1SC(N(C(Nc2cccc(Cl)c2)=O)c(cc2)ccc2OC(F)(F)Cl)=NC1

InChI

InChI=1S/C18H15Cl2F2N3O2S/c1-11-10-23-17(28-11)25(16(26)24-13-4-2-3-12(19)9-13)14-5-7-15(8-6-14)27-18(20,21)22/h2-9,11H,10H2,1H3,(H,24,26)/t11-/m1/s1

InChI Key

IXVKRBKFCNWEOQ-LLVKDONJSA-N

MDL Number (MFCD)

MFCD02934287

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.841

Distribution Coefficient, logD

5.831

Water Solubility, LogSw

-5.98

Polar Surface Area

39.236

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 8012-2262 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-2262?
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What is the minimum amount of 8012-2262 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-2262
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-2262
  • 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 8012-2262 available by request