MedKoo Cat#: 130398 | Name: BocA1V2PF1-NHPEG3-NH2
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

BocA1V2PF1-NHPEG3-NH2 is a vital component in the synthesis of targeted protein degraders and specific and non-genetic inhibitor of apoptosis protein (IAP)-dependent protein erasers (SNIPERs). The conjugate is comprised of an IAP-recruiting ligand, an alkyl-chain crosslinker, and a pendant amine, with the pendant amine reacting with an acid on a target warhead.

Chemical Structure

BocA1V2PF1-NHPEG3-NH2
BocA1V2PF1-NHPEG3-NH2
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 130398

Name: BocA1V2PF1-NHPEG3-NH2

CAS#: N/A

Chemical Formula: C38H62N6O9

Exact Mass: 746.4578

Molecular Weight: 746.95

Elemental Analysis: C, 61.10; H, 8.37; N, 11.25; O, 19.28

Price and Availability

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50mg USD 750.00 2 Weeks
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Related CAS #
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Synonym
BocA1V2PF1-NHPEG3-NH2
IUPAC/Chemical Name
tert-butyl ((S)-1-(((S)-2-((S)-2-(((S)-1-amino-13-oxo-15-phenyl-3,6,9-trioxa-12-azapentadecan-14-yl)carbamoyl)pyrrolidin-1-yl)-1-cyclohexyl-2-oxoethyl)amino)-1-oxopropan-2-yl)carbamate
InChi Key
OASZCJLPYPSNDH-QJANCWQKSA-N
InChi Code
InChI=1S/C38H62N6O9/c1-27(41-37(49)53-38(2,3)4)33(45)43-32(29-14-9-6-10-15-29)36(48)44-19-11-16-31(44)35(47)42-30(26-28-12-7-5-8-13-28)34(46)40-18-21-51-23-25-52-24-22-50-20-17-39/h5,7-8,12-13,27,29-32H,6,9-11,14-26,39H2,1-4H3,(H,40,46)(H,41,49)(H,42,47)(H,43,45)/t27-,30-,31-,32-/m0/s1
SMILES Code
O=C(OC(C)(C)C)N[C@@H](C)C(N[C@@H](C1CCCCC1)C(N2[C@H](C(N[C@@H](CC3=CC=CC=C3)C(NCCOCCOCCOCCN)=O)=O)CCC2)=O)=O
Appearance
Solid
Purity
>85% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 746.95 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL