V004-8035 Screening compound: N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-[N-(butan-2-yl)-1-[4-(trifluoromethyl)phenyl]formamido]-N-cyclohexylacetamide

V004-8035 Screening compound: N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-[N-(butan-2-yl)-1-[4-(trifluoromethyl)phenyl]formamido]-N-cyclohexylacetamide
V004-8035 Screening compound: N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-[N-(butan-2-yl)-1-[4-(trifluoromethyl)phenyl]formamido]-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-8035
N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-[N-(butan-2-yl)-1-[4-(trifluoromethyl)phenyl]formamido]-N-cyclohexylacetamide

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

V004-8035

Molecular Formula

C32H37BrF3N3O2 (C32 H37 BrF3 N3 O2)

Compound Name

N-({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-[N-(butan-2-yl)-1-[4-(trifluoromethyl)phenyl]formamido]-N-cyclohexylacetamide

IUPAC name

n/a

SMILES

CCC(C)N(CC(N(Cc1cccn1Cc(cc1)ccc1Br)C1CCCCC1)=O)C(c1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C32H37BrF3N3O2/c1-3-23(2)38(31(41)25-13-15-26(16-14-25)32(34,35)36)22-30(40)39(28-8-5-4-6-9-28)21-29-10-7-19-37(29)20-24-11-17-27(33)18-12-24/h7,10-19,23,28H,3-6,8-9,20-22H2,1-2H3/t23-/m0/s1

InChI Key

WFFRHUGONVMPEF-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19732328

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

632.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.905

Distribution Coefficient, logD

7.905

Water Solubility, LogSw

-5.70

Polar Surface Area

32.776

Acid Dissociation Constant (pKa)

23.06

Base Dissociation Constant (pKb)

-0.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with V004-8035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-8035?
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What is the minimum amount of V004-8035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-8035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-8035
  • 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 V004-8035 available by request