4465-2467 Screening compound: benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate

4465-2467 Screening compound: benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate
4465-2467 Screening compound: benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4465-2467
benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate

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

4465-2467

Molecular Formula

C23H35N3O6 (C23 H35 N3 O6)

Compound Name

benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate

IUPAC name

benzyl 4-(2-{[(tert-butoxy)carbonyl]amino}-3-methylpentanamido)-4-carbamoylbutanoate

SMILES

CCC(C)C(C(NC(CCC(OCc1ccccc1)=O)C(N)=O)=O)NC(OC(C)(C)C)=O

InChI

InChI=1S/C23H35N3O6/c1-6-15(2)19(26-22(30)32-23(3,4)5)21(29)25-17(20(24)28)12-13-18(27)31-14-16-10-8-7-9-11-16/h7-11,15,17,19H,6,12-14H2,1-5H3,(H2,24,28)(H,25,29)(H,26,30)

InChI Key

QEZBEOOFSRNPCR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00619179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.988

Distribution Coefficient, logD

3.988

Water Solubility, LogSw

-4.37

Polar Surface Area

110.374

Acid Dissociation Constant (pKa)

14.18

Base Dissociation Constant (pKb)

1.35

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

56.50

References: we are preparing a list of scientific research reports with 4465-2467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4465-2467?
Check Price and Availability of 4465-2467, 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 4465-2467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4465-2467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4465-2467
  • 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 4465-2467 available by request