V028-6109 Screening compound: (3,5-difluorophenyl)[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]methanone

V028-6109 Screening compound: (3,5-difluorophenyl)[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]methanone
V028-6109 Screening compound: (3,5-difluorophenyl)[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6109
(3,5-difluorophenyl)[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]methanone

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

V028-6109

Molecular Formula

C27H25F2N3O3 (C27 H25 F2 N3 O3)

Compound Name

(3,5-difluorophenyl)[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]methanone

IUPAC name

10-[4-(35-difluorobenzoyl)-14-diazepan-1-yl]-14-methoxy-5-methyl-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)35791214-heptaene

SMILES

Cc(cc1)cc(Oc2c3ccc(OC)c2)c1N=C3N(CCC1)CCN1C(c1cc(F)cc(F)c1)=O

InChI

InChI=1S/C27H25F2N3O3/c1-17-4-7-23-25(12-17)35-24-16-21(34-2)5-6-22(24)26(30-23)31-8-3-9-32(11-10-31)27(33)18-13-19(28)15-20(29)14-18/h4-7,12-16H,3,8-11H2,1-2H3

InChI Key

JZLLGCXBHGVNAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14283063

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

477.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.978

Distribution Coefficient, logD

3.988

Water Solubility, LogSw

-4.73

Polar Surface Area

42.593

Acid Dissociation Constant (pKa)

27.65

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with V028-6109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6109?
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What is the minimum amount of V028-6109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6109
  • 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 V028-6109 available by request