1597-0043 Screening compound: 2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid

1597-0043 Screening compound: 2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid
1597-0043 Screening compound: 2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1597-0043
2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid

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

1597-0043

Molecular Formula

C13H20N2O3 (C13 H20 N2 O3)

Compound Name

2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid

IUPAC name

2-{[(adamantan-1-yl)carbamoyl]amino}acetic acid

SMILES

OC(CNC(NC1(CC(C2)C3)CC3CC2C1)=O)=O

InChI

InChI=1S/C13H20N2O3/c16-11(17)7-14-12(18)15-13-4-8-1-9(5-13)3-10(2-8)6-13/h8-10H,1-7H2,(H,16,17)(H2,14,15,18)

InChI Key

BCQDSYAFMNYXTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01791134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

252.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.032

Distribution Coefficient, logD

-2.507

Water Solubility, LogSw

-1.72

Polar Surface Area

63.537

Acid Dissociation Constant (pKa)

3.86

Base Dissociation Constant (pKb)

3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

84.60

References: we are preparing a list of scientific research reports with 1597-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1597-0043?
Check Price and Availability of 1597-0043, 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 1597-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1597-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1597-0043
  • 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 1597-0043 available by request