MedKoo Cat#: 462420 | Name: CAIX Inhibitor S4
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Description:

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

CAIX Inhibitor S4 is an inhibitor of carbonic anhydrase IX. It is selective for CAIX over CAI and CAII but does inhibit CAXII. It reduced the number of lung metastases, but not primary tumor growth, in an MDA-MB-231 mouse xenograft model.

Chemical Structure

CAIX Inhibitor S4
CAIX Inhibitor S4
CAS#1330061-67-0

Theoretical Analysis

MedKoo Cat#: 462420

Name: CAIX Inhibitor S4

CAS#: 1330061-67-0

Chemical Formula: C15H17N3O4S

Exact Mass: 335.0940

Molecular Weight: 335.38

Elemental Analysis: C, 53.72; H, 5.11; N, 12.53; O, 19.08; S, 9.56

Price and Availability

Size Price Availability Quantity
100mg USD 950.00 2 Weeks
200mg USD 1,650.00 2 Weeks
500mg USD 3,250.00 2 Weeks
1g USD 4,650.00 2 Weeks
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Related CAS #
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Synonym
CAIX Inhibitor S4
IUPAC/Chemical Name
4-(3-(3,5-dimethylphenyl)ureido)phenyl sulfamate
InChi Key
HGVHSNXRZYOTPD-UHFFFAOYSA-N
InChi Code
InChI=1S/C15H17N3O4S/c1-10-7-11(2)9-13(8-10)18-15(19)17-12-3-5-14(6-4-12)22-23(16,20)21/h3-9H,1-2H3,(H2,16,20,21)(H2,17,18,19)
SMILES Code
O=S(OC[5]=CC=C(NC(NC[16]=CC(C)=CC(C)=C@16)=O)C=C@6)(N)=O
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 335.38 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: Gieling, R.G., Babur, M., Mamnani, L., et al. Antimetastatic effect of sulfamate carbonic anhydrase IX inhibitors in breast carcinoma xenografts. J. Med. Chem. 55(11), 5591-5600 (2012).