V005-7610 Screening compound: 4-methyl-2-{[1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol

V005-7610 Screening compound: 4-methyl-2-{[1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol
V005-7610 Screening compound: 4-methyl-2-{[1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-7610
4-methyl-2-{[1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol

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

V005-7610

Molecular Formula

C22H21F3N2O (C22 H21 F3 N2 O)

Compound Name

4-methyl-2-{[1-(2,4,5-trifluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol

IUPAC name

4-methyl-2-{[1-(245-trifluorophenyl)-1H2H3H4H5H-pyrrolo[12-a][14]diazepin-2-yl]methyl}phenol

SMILES

Cc(cc1)cc(CN(CCCn2c3ccc2)C3c(c(F)c2)cc(F)c2F)c1O

InChI

InChI=1S/C22H21F3N2O/c1-14-5-6-21(28)15(10-14)13-27-9-3-8-26-7-2-4-20(26)22(27)16-11-18(24)19(25)12-17(16)23/h2,4-7,10-12,22,28H,3,8-9,13H2,1H3/t22-/m1/s1

InChI Key

HIPSMMLXWSITPY-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19893142

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

386.42

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.961

Distribution Coefficient, logD

4.959

Water Solubility, LogSw

-4.26

Polar Surface Area

22.490

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

5.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with V005-7610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-7610?
Check Price and Availability of V005-7610, 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 V005-7610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-7610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-7610
  • 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 V005-7610 available by request