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MedKoo Cat#: 574625 | Name: Chlorodenafil

Description:

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

Chlorodenafil is a related compound of Sildenafil -- a phosphodiesterase inhibitor.

Chemical Structure

Chlorodenafil
Chlorodenafil
CAS#1058653-74-9

Theoretical Analysis

MedKoo Cat#: 574625

Name: Chlorodenafil

CAS#: 1058653-74-9

Chemical Formula: C19H21ClN4O3

Exact Mass: 388.1302

Molecular Weight: 388.85

Elemental Analysis: C, 58.69; H, 5.44; Cl, 9.12; N, 14.41; O, 12.34

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Related CAS #
No Data
Synonym
Chlorodenafil
IUPAC/Chemical Name
5-[5-(2-Chloroacetyl)-2-ethoxyphenyl]-1,6-dihydro-1-methyl-3-propyl-7H-pyrazolo[4,3-d]pyrimidin-7-one
InChi Key
UOJGGFDIPKRVTP-UHFFFAOYSA-N
InChi Code
InChI=1S/C19H21ClN4O3/c1-4-6-13-16-17(24(3)23-13)19(26)22-18(21-16)12-9-11(14(25)10-20)7-8-15(12)27-5-2/h7-9H,4-6,10H2,1-3H3,(H,21,22,26)
SMILES Code
O=C1C(N(C)N=C2CCC)=C2N=C(C3=CC(C(CCl)=O)=CC=C3OCC)N1
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 388.85 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. Kim JY, Hwang IG, Oh JH, Kang IH, Kwon SW, Kim D. Efficient synthesis of dichlorodenafil, an unapproved sildenafil analogue appearing in non-prescription supplements. Chem Pharm Bull (Tokyo). 2013;61(5):572-575. doi:10.1248/cpb.c12-00907