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MedKoo Cat#: 462239 | Name: NCI172112

Description:

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

NCI172112 is a classical bifunctional alkylating agent synthesized in an effort to develop antitumor agents effective against CNS tumors.

Chemical Structure

NCI172112
NCI172112
CAS#56605-16-4

Theoretical Analysis

MedKoo Cat#: 462239

Name: NCI172112

CAS#: 56605-16-4

Chemical Formula: C14H23Cl2N3O2

Exact Mass: 335.1167

Molecular Weight: 336.26

Elemental Analysis: C, 50.01; H, 6.89; Cl, 21.09; N, 12.50; O, 9.52

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
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Synonym
NCI172112; NCI-172112; NCI 172112; NSC172112; NSC-268497; NSC268497; NSC 268497
IUPAC/Chemical Name
3-(2-(bis(2-chloroethyl)amino)ethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
InChi Key
QNKJFXARIMSDBR-UHFFFAOYSA-N
InChi Code
InChI=1S/C14H23Cl2N3O2/c15-6-8-18(9-7-16)10-11-19-12(20)14(17-13(19)21)4-2-1-3-5-14/h1-11H2,(H,17,21)
SMILES Code
ClCCN(CCN1C(C2(CCCCC2)NC1=O)=O)CCCl
Appearance
Solid powder
Purity
>98% (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
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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 336.26 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
1: Brown TD, Ettinger DS, Donehower RC. A phase I trial of spirohydantoin mustard (NSC 172112) in patients with advanced cancer. J Clin Oncol. 1986;4(8):1270-1276. doi:10.1200/JCO.1986.4.8.1270 2: Plowman J, Adamson RH. The disposition of spirohydantoin mustard (NSC 172112) in rats and dogs. Xenobiotica. 1979;9(6):379-391. doi:10.3109/00498257909038740