G765-0080 Screening compound: N-(3,4-dihydro-2H-1-benzopyran-3-yl)-4-(2,3-dimethylphenyl)piperazine-1-carboxamide

G765-0080 Screening compound: N-(3,4-dihydro-2H-1-benzopyran-3-yl)-4-(2,3-dimethylphenyl)piperazine-1-carboxamide
G765-0080 Screening compound: N-(3,4-dihydro-2H-1-benzopyran-3-yl)-4-(2,3-dimethylphenyl)piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G765-0080
N-(3,4-dihydro-2H-1-benzopyran-3-yl)-4-(2,3-dimethylphenyl)piperazine-1-carboxamide

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

G765-0080

Molecular Formula

C22H27N3O2 (C22 H27 N3 O2)

Compound Name

N-(3,4-dihydro-2H-1-benzopyran-3-yl)-4-(2,3-dimethylphenyl)piperazine-1-carboxamide

IUPAC name

N-(34-dihydro-2H-1-benzopyran-3-yl)-4-(23-dimethylphenyl)piperazine-1-carboxamide

SMILES

Cc1cccc(N(CC2)CCN2C(NC(C2)COc3c2cccc3)=O)c1C

InChI

InChI=1S/C22H27N3O2/c1-16-6-5-8-20(17(16)2)24-10-12-25(13-11-24)22(26)23-19-14-18-7-3-4-9-21(18)27-15-19/h3-9,19H,10-15H2,1-2H3,(H,23,26)/t19-/m0/s1

InChI Key

NERGTELKOMCIDH-IBGZPJMESA-N

MDL Number (MFCD)

MFCD15034233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.752

Distribution Coefficient, logD

4.747

Water Solubility, LogSw

-4.43

Polar Surface Area

37.892

Acid Dissociation Constant (pKa)

15.97

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

G765-0080 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with G765-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G765-0080?
Check Price and Availability of G765-0080, 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 G765-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G765-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G765-0080
  • 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 G765-0080 available by request