V007-8457 Screening compound: 2-[7-chloro-3-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide

V007-8457 Screening compound: 2-[7-chloro-3-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide
V007-8457 Screening compound: 2-[7-chloro-3-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-8457
2-[7-chloro-3-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide

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

V007-8457

Molecular Formula

C21H20ClN3O4 (C21 H20 ClN3 O4)

Compound Name

2-[7-chloro-3-(2-methoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide

IUPAC name

2-[7-chloro-3-(2-methoxyphenyl)-24-dioxo-1234-tetrahydroquinazolin-1-yl]-N-cyclopropylpropanamide

SMILES

CC(C(NC1CC1)=O)N(c(cc(cc1)Cl)c1C(N1c(cccc2)c2OC)=O)C1=O

InChI

InChI=1S/C21H20ClN3O4/c1-12(19(26)23-14-8-9-14)24-17-11-13(22)7-10-15(17)20(27)25(21(24)28)16-5-3-4-6-18(16)29-2/h3-7,10-12,14H,8-9H2,1-2H3,(H,23,26)/t12-/m0/s1

InChI Key

XAJYOEQUFZMGIH-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD19792241

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.86

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.380

Distribution Coefficient, logD

2.380

Water Solubility, LogSw

-3.48

Polar Surface Area

62.067

Acid Dissociation Constant (pKa)

13.81

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

V007-8457 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V007-8457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-8457?
Check Price and Availability of V007-8457, 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 V007-8457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-8457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-8457
  • 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 V007-8457 available by request