V010-0770 Screening compound: N-allyl-N'-(8-chloro-11-morpholinodibenzo[b,f][1,4]oxazepin-2-yl)urea

V010-0770 Screening compound: N-allyl-N'-(8-chloro-11-morpholinodibenzo[b,f][1,4]oxazepin-2-yl)urea
V010-0770 Screening compound: N-allyl-N'-(8-chloro-11-morpholinodibenzo[b,f][1,4]oxazepin-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-0770
N-allyl-N'-(8-chloro-11-morpholinodibenzo[b,f][1,4]oxazepin-2-yl)urea

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

V010-0770

Molecular Formula

C21H21ClN4O3 (C21 H21 ClN4 O3)

Compound Name

N-allyl-N'-(8-chloro-11-morpholinodibenzo[b,f][1,4]oxazepin-2-yl)urea

IUPAC name

1-[6-chloro-10-(morpholin-4-yl)-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)35791214-heptaen-13-yl]-3-(prop-2-en-1-yl)urea

SMILES

C=CCNC(Nc(cc1)cc2c1Oc(ccc(Cl)c1)c1N=C2N1CCOCC1)=O

InChI

InChI=1S/C21H21ClN4O3/c1-2-7-23-21(27)24-15-4-6-18-16(13-15)20(26-8-10-28-11-9-26)25-17-12-14(22)3-5-19(17)29-18/h2-6,12-13H,1,7-11H2,(H2,23,24,27)

InChI Key

IKKHBKNHFZGBCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14265875

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

412.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.369

Distribution Coefficient, logD

3.303

Water Solubility, LogSw

-3.94

Polar Surface Area

59.909

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V010-0770 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V010-0770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-0770?
Check Price and Availability of V010-0770, 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 V010-0770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-0770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-0770
  • 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 V010-0770 available by request