V010-0637 Screening compound: 2-(adamantane-1-carbonyl)-1-(3-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

V010-0637 Screening compound: 2-(adamantane-1-carbonyl)-1-(3-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
V010-0637 Screening compound: 2-(adamantane-1-carbonyl)-1-(3-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-0637
2-(adamantane-1-carbonyl)-1-(3-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

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

V010-0637

Molecular Formula

C28H32ClNO3 (C28 H32 ClNO3)

Compound Name

2-(adamantane-1-carbonyl)-1-(3-chlorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

IUPAC name

1-(3-chlorophenyl)-67-dimethoxy-2-[(3R5S7s)-adamantane-1-carbonyl]-1234-tetrahydroisoquinoline

SMILES

COc1cc(CCN(C2c3cccc(Cl)c3)C(C3(C[C@H](C4)C5)C[C@H]5C[C@H]4C3)=O)c2cc1OC

InChI

InChI=1S/C28H32ClNO3/c1-32-24-12-20-6-7-30(27(31)28-14-17-8-18(15-28)10-19(9-17)16-28)26(23(20)13-25(24)33-2)21-4-3-5-22(29)11-21/h3-5,11-13,17-19,26H,6-10,14-16H2,1-2H3/t17?,18?,19?,26-,28?/m0/s1

InChI Key

DEDXSJDHHYMHQR-RIJXQDIUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.02

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.509

Distribution Coefficient, logD

6.509

Water Solubility, LogSw

-6.40

Polar Surface Area

31.155

Acid Dissociation Constant (pKa)

23.73

Base Dissociation Constant (pKb)

-4.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.60

V010-0637 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V010-0637 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-0637?
Check Price and Availability of V010-0637, 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 V010-0637 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-0637
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-0637
  • 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 V010-0637 available by request