V005-7605 Screening compound: 2-{[1-(2,3-difluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol

V005-7605 Screening compound: 2-{[1-(2,3-difluorophenyl)-1H,2H,3H,4H,5H-pyrrolo[1,2-a][1,4]diazepin-2-yl]methyl}phenol
V005-7605 Screening compound: 2-{[1-(2,3-difluorophenyl)-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 V005-7605
2-{[1-(2,3-difluorophenyl)-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

V005-7605

Molecular Formula

C21H20F2N2O (C21 H20 F2 N2 O)

Compound Name

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

IUPAC name

2-{[1-(23-difluorophenyl)-1H2H3H4H5H-pyrrolo[12-a][14]diazepin-2-yl]methyl}phenol

SMILES

Oc1c(CN(CCCn2c3ccc2)C3c2cccc(F)c2F)cccc1

InChI

InChI=1S/C21H20F2N2O/c22-17-8-3-7-16(20(17)23)21-18-9-4-11-24(18)12-5-13-25(21)14-15-6-1-2-10-19(15)26/h1-4,6-11,21,26H,5,12-14H2/t21-/m1/s1

InChI Key

VSGVWENQNDCAJR-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19893118

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

354.4

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

4.543

Distribution Coefficient, logD

4.540

Water Solubility, LogSw

-3.97

Polar Surface Area

22.490

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with V005-7605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-7605?
Check Price and Availability of V005-7605, 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 V005-7605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-7605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-7605
  • 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 V005-7605 available by request