V017-0536 Screening compound: [4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl](2-methoxyphenyl)methanone

V017-0536 Screening compound: [4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl](2-methoxyphenyl)methanone
V017-0536 Screening compound: [4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl](2-methoxyphenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-0536
[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl](2-methoxyphenyl)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

V017-0536

Molecular Formula

C27H27N3O4 (C27 H27 N3 O4)

Compound Name

[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl](2-methoxyphenyl)methanone

IUPAC name

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

SMILES

COc(cccc1)c1C(N(CCC1)CCN1C1=Nc(cccc2)c2Oc2c1cccc2OC)=O

InChI

InChI=1S/C27H27N3O4/c1-32-22-12-5-3-9-19(22)27(31)30-16-8-15-29(17-18-30)26-20-10-7-14-24(33-2)25(20)34-23-13-6-4-11-21(23)28-26/h3-7,9-14H,8,15-18H2,1-2H3

InChI Key

OKFXSVJZFVAWGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14283426

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

457.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.630

Distribution Coefficient, logD

2.533

Water Solubility, LogSw

-3.99

Polar Surface Area

49.994

Acid Dissociation Constant (pKa)

27.65

Base Dissociation Constant (pKb)

8.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with V017-0536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-0536?
Check Price and Availability of V017-0536, 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 V017-0536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-0536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-0536
  • 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 V017-0536 available by request